{"Abbreviation":["MDAR"],"ChemicalClasses":["aminorex","methylenedioxyphenethylamine"],"Chirality":"racemic","Esters":[],"Formating":[],"HeavyAtomCount":15,"IUPACName":"5-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3-oxazol-2-amine","InChI":"InChI=1S/C10H10N2O3/c11-10-12-4-9(15-10)6-1-2-7-8(3-6)14-5-13-7/h1-3,9H,4-5H2,(H2,11,12)","InChIKey":"LOFGJCSNVFFVRE-UHFFFAOYSA-N","MolecularFormula":"C\u003csub\u003e10\u003c/sub\u003eH\u003csub\u003e10\u003c/sub\u003eN\u003csub\u003e2\u003c/sub\u003eO\u003csub\u003e3\u003c/sub\u003e","MolecularWeight":"206.20 g/mol","PubChemId":91619097,"RefCount":2,"RefCur":"","References":[{"Name":"PubChem","Urls":[{"Link":"https://pubchem.ncbi.nlm.nih.gov/compound/91619097","Name":"(RS)-3',4'-Methylenedioxyaminorex","Sub":false}]}],"Refs":["National Center for Biotechnology Information. PubChem Compound Summary for CID 91619097, (RS)-3',4'-Methylenedioxyaminorex. Accessed September 15, 2025. \u003ca href=https://pubchem.ncbi.nlm.nih.gov/compound/91619097\u003ehttps://pubchem.ncbi.nlm.nih.gov/compound/91619097\u003c/a\u003e"],"SMILES":"C1C(OC(=N1)N)C2=CC3=C(C=C2)OCO3","SaltData":[],"Salts":[],"StereoisomerData":[{"Aliases":null,"PubChemId":null,"SMILES":"NC1=NC[C@@H](C2=CC3=C(C=C2)OCO3)O1","Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 112.611 52.83\"\u003e\u003crect width=\"100%\" height=\"100%\" fill=\"#fff\"/\u003e\u003cdesc\u003eGenerated by the Chemistry Development Kit (http://github.com/cdk)\u003c/desc\u003e\u003cg fill=\"#3050f8\" stroke=\"#000\" stroke-linecap=\"round\" stroke-linejoin=\"round\" stroke-width=\".7\"\u003e\u003cpath fill=\"#fff\" stroke=\"none\" d=\"M0 0h113v53H0z\"/\u003e\u003cg class=\"mol\"\u003e\u003cpath d=\"m99.965 17.315-11.83-1.184\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m88.135 16.131-5.482-9.46M85.143 15.832l-4.6-7.939\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m82.653 6.671 2.741 4.73M80.543 7.893l2.3 3.97\" class=\"hi\"/\u003e\u003c/g\u003e\u003cpath d=\"m77.222 3.722-11.59 2.493M65.632 6.215l-1.534 15.088\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m64.273 21.606-.35-.606M62.219 23.129l-.642-1.112M60.165 24.651l-.933-1.617M58.111 26.174l-1.225-2.122M56.058 27.697l-1.517-2.628M54.004 29.219l-1.809-3.132M51.95 30.742l-2.1-3.638\"/\u003e\u003c/g\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m50.9 28.923-13.203-7.629M48.462 30.33l-10.766-6.22\"/\u003e\u003c/g\u003e\u003cpath d=\"m37.697 21.294-13.199 7.62\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m24.498 28.914.005 15.249M26.937 30.322l.004 12.433\"/\u003e\u003c/g\u003e\u003cpath d=\"m24.503 44.163 13.203 7.628\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m37.706 51.791 13.199-7.62M37.707 48.975l10.759-6.211\"/\u003e\u003c/g\u003e\u003cpath d=\"m50.9 28.923.005 15.248M24.503 44.163 13.6 47.705M7.69 45.682l-6.641-9.136M1.049 36.546l6.635-9.14M24.498 28.914l-10.906-3.535M64.098 21.303l10.475 4.706M88.135 16.131l-7.485 8.454\" class=\"bond\"/\u003e\u003cg stroke=\"none\" class=\"atom\"\u003e\u003cpath d=\"M105.24 20.098h-.72l-2.62-4.066h-.029l.029.596q.024.357.024.732v2.738h-.565v-4.899h.714l2.608 4.054h.029l-.018-.327-.023-.477q-.006-.262-.006-.482v-2.768h.577zM109.546 20.098h-.619v-2.286h-2.512v2.286h-.613v-4.899h.613v2.072h2.512v-2.072h.619zM112.051 21.588h-1.943v-.3l.772-.779q.221-.221.371-.393.154-.175.232-.339.079-.168.079-.364 0-.243-.147-.368-.143-.129-.371-.129-.214 0-.379.075-.161.075-.328.207l-.193-.243q.171-.146.393-.246.225-.1.507-.1.411 0 .65.207t.239.575q0 .229-.096.432-.093.2-.265.397-.167.196-.392.418l-.615.603v.018h1.486z\"/\u003e\u003c/g\u003e\u003cpath stroke=\"none\" d=\"M82.472 5.459h-.72l-2.62-4.066h-.029l.029.596q.024.357.024.732v2.738h-.565V.56h.714l2.608 4.054h.029l-.018-.327-.023-.477q-.006-.262-.006-.482V.56h.577z\" class=\"atom\"/\u003e\u003cpath fill=\"#ff0d0d\" stroke=\"none\" d=\"M12.268 48.869q0 .756-.256 1.328-.256.565-.756.881-.5.315-1.244.315-.756 0-1.262-.315-.506-.316-.756-.887-.244-.572-.244-1.334 0-.75.244-1.309.25-.566.756-.881t1.274-.316q.732 0 1.232.316.5.309.756.875.256.565.256 1.327m-3.863 0q0 .923.387 1.459.393.53 1.22.53.839 0 1.22-.53.387-.536.387-1.459 0-.928-.387-1.452-.381-.524-1.208-.524-.833 0-1.226.524t-.393 1.452M12.26 24.211q0 .756-.256 1.328-.256.566-.756.881t-1.244.316q-.756 0-1.262-.316-.506-.315-.756-.887-.244-.571-.244-1.333 0-.751.244-1.31.25-.566.756-.881t1.274-.316q.732 0 1.232.316.5.309.756.875.256.565.256 1.327m-3.863 0q0 .923.387 1.459.393.53 1.22.53.84 0 1.221-.53.387-.536.387-1.459 0-.928-.387-1.452-.381-.524-1.209-.524-.833 0-1.226.524t-.393 1.452M80.278 27.554q0 .756-.256 1.328-.256.565-.756.881-.5.315-1.244.315-.756 0-1.262-.315-.506-.316-.757-.887-.244-.572-.244-1.334 0-.75.244-1.31.251-.565.757-.881.506-.315 1.274-.315.732 0 1.232.315.5.31.756.876.256.565.256 1.327m-3.864 0q0 .923.387 1.459.393.529 1.221.529.839 0 1.22-.529.387-.536.387-1.459 0-.929-.387-1.452-.381-.524-1.208-.524-.834 0-1.227.524-.393.523-.393 1.452\" class=\"atom\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m99.965 17.315-5.915-.592M77.222 3.722l-5.795 1.246\" class=\"hi\"/\u003e\u003cpath stroke=\"#ff0d0d\" d=\"m13.6 47.705 5.452-1.771M7.69 45.682l-3.32-4.568M7.684 27.406l-3.317 4.57M13.592 25.379l5.453 1.768M74.573 26.009l-5.238-2.353M80.65 24.585l3.743-4.227\" class=\"hi\"/\u003e\u003c/g\u003e\u003c/g\u003e\u003c/svg\u003e","Title":"(R)-3',4'-Methylenedioxyaminorex","UNII":null},{"Aliases":null,"PubChemId":null,"SMILES":"NC1=NC[C@H](C2=CC3=C(C=C2)OCO3)O1","Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 112.611 52.83\"\u003e\u003crect width=\"100%\" height=\"100%\" fill=\"#fff\"/\u003e\u003cdesc\u003eGenerated by the Chemistry Development Kit (http://github.com/cdk)\u003c/desc\u003e\u003cg fill=\"#3050f8\" stroke=\"#000\" stroke-linecap=\"round\" stroke-linejoin=\"round\" stroke-width=\".7\"\u003e\u003cpath fill=\"#fff\" stroke=\"none\" d=\"M0 0h113v53H0z\"/\u003e\u003cg class=\"mol\"\u003e\u003cpath d=\"m99.965 17.315-11.83-1.184\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m88.135 16.131-5.482-9.46M85.143 15.832l-4.6-7.939\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m82.653 6.671 2.741 4.73M80.543 7.893l2.3 3.97\" class=\"hi\"/\u003e\u003c/g\u003e\u003cpath d=\"m77.222 3.722-11.59 2.493M65.632 6.215l-1.534 15.088\" class=\"bond\"/\u003e\u003cpath fill=\"#000\" stroke=\"none\" d=\"m64.273 21.606-.35-.606-15.272 6.624 2.249 1.299v2.597z\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m50.9 28.923-13.203-7.629M48.462 30.33l-10.766-6.22\"/\u003e\u003c/g\u003e\u003cpath d=\"m37.697 21.294-13.199 7.62\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m24.498 28.914.005 15.249M26.937 30.322l.004 12.433\"/\u003e\u003c/g\u003e\u003cpath d=\"m24.503 44.163 13.203 7.628\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m37.706 51.791 13.199-7.62M37.707 48.975l10.759-6.211\"/\u003e\u003c/g\u003e\u003cpath d=\"m50.9 28.923.005 15.248M24.503 44.163 13.6 47.705M7.69 45.682l-6.641-9.136M1.049 36.546l6.635-9.14M24.498 28.914l-10.906-3.535M64.098 21.303l10.475 4.706M88.135 16.131l-7.485 8.454\" class=\"bond\"/\u003e\u003cg stroke=\"none\" class=\"atom\"\u003e\u003cpath d=\"M105.24 20.098h-.72l-2.62-4.066h-.029l.029.596q.024.357.024.732v2.738h-.565v-4.899h.714l2.608 4.054h.029l-.018-.327-.023-.477q-.006-.262-.006-.482v-2.768h.577zM109.546 20.098h-.619v-2.286h-2.512v2.286h-.613v-4.899h.613v2.072h2.512v-2.072h.619zM112.051 21.588h-1.943v-.3l.772-.779q.221-.221.371-.393.154-.175.232-.339.079-.168.079-.364 0-.243-.147-.368-.143-.129-.371-.129-.214 0-.379.075-.161.075-.328.207l-.193-.243q.171-.146.393-.246.225-.1.507-.1.411 0 .65.207t.239.575q0 .229-.096.432-.093.2-.265.397-.167.196-.392.418l-.615.603v.018h1.486z\"/\u003e\u003c/g\u003e\u003cpath stroke=\"none\" d=\"M82.472 5.459h-.72l-2.62-4.066h-.029l.029.596q.024.357.024.732v2.738h-.565V.56h.714l2.608 4.054h.029l-.018-.327-.023-.477q-.006-.262-.006-.482V.56h.577z\" class=\"atom\"/\u003e\u003cpath fill=\"#ff0d0d\" stroke=\"none\" d=\"M12.268 48.869q0 .756-.256 1.328-.256.565-.756.881-.5.315-1.244.315-.756 0-1.262-.315-.506-.316-.756-.887-.244-.572-.244-1.334 0-.75.244-1.309.25-.566.756-.881t1.274-.316q.732 0 1.232.316.5.309.756.875.256.565.256 1.327m-3.863 0q0 .923.387 1.459.393.53 1.22.53.839 0 1.22-.53.387-.536.387-1.459 0-.928-.387-1.452-.381-.524-1.208-.524-.833 0-1.226.524t-.393 1.452M12.26 24.211q0 .756-.256 1.328-.256.566-.756.881t-1.244.316q-.756 0-1.262-.316-.506-.315-.756-.887-.244-.571-.244-1.333 0-.751.244-1.31.25-.566.756-.881t1.274-.316q.732 0 1.232.316.5.309.756.875.256.565.256 1.327m-3.863 0q0 .923.387 1.459.393.53 1.22.53.84 0 1.221-.53.387-.536.387-1.459 0-.928-.387-1.452-.381-.524-1.209-.524-.833 0-1.226.524t-.393 1.452M80.278 27.554q0 .756-.256 1.328-.256.565-.756.881-.5.315-1.244.315-.756 0-1.262-.315-.506-.316-.757-.887-.244-.572-.244-1.334 0-.75.244-1.31.251-.565.757-.881.506-.315 1.274-.315.732 0 1.232.315.5.31.756.876.256.565.256 1.327m-3.864 0q0 .923.387 1.459.393.529 1.221.529.839 0 1.22-.529.387-.536.387-1.459 0-.929-.387-1.452-.381-.524-1.208-.524-.834 0-1.227.524-.393.523-.393 1.452\" class=\"atom\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m99.965 17.315-5.915-.592M77.222 3.722l-5.795 1.246\" class=\"hi\"/\u003e\u003cpath stroke=\"#ff0d0d\" d=\"m13.6 47.705 5.452-1.771M7.69 45.682l-3.32-4.568M7.684 27.406l-3.317 4.57M13.592 25.379l5.453 1.768M74.573 26.009l-5.238-2.353M80.65 24.585l3.743-4.227\" class=\"hi\"/\u003e\u003c/g\u003e\u003c/g\u003e\u003c/svg\u003e","Title":"(S)-3',4'-Methylenedioxyaminorex","UNII":null}],"StereoisomerType":"enantiomer","Stereoisomers":["(R)-3',4'-Methylenedioxyaminorex","(S)-3',4'-Methylenedioxyaminorex"],"Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 112.611 52.83\"\u003e\u003crect width=\"100%\" height=\"100%\" fill=\"#fff\"/\u003e\u003cdesc\u003eGenerated by the Chemistry Development Kit (http://github.com/cdk)\u003c/desc\u003e\u003cg fill=\"#3050f8\" stroke=\"#000\" stroke-linecap=\"round\" stroke-linejoin=\"round\" stroke-width=\".7\"\u003e\u003cpath fill=\"#fff\" stroke=\"none\" d=\"M0 0h113v53H0z\"/\u003e\u003cg class=\"mol\"\u003e\u003cpath d=\"m65.632 6.215-1.534 15.088M64.098 21.303l10.475 4.706M80.65 24.585l7.485-8.454\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m88.135 16.131-5.482-9.46M85.143 15.832l-4.6-7.939\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m82.653 6.671 2.741 4.73M80.543 7.893l2.3 3.97\" class=\"hi\"/\u003e\u003c/g\u003e\u003cpath d=\"m65.632 6.215 11.59-2.493M88.135 16.131l11.83 1.184M64.098 21.303 50.9 28.923\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m50.9 28.923-13.203-7.629M48.462 30.33l-10.766-6.22\"/\u003e\u003c/g\u003e\u003cpath d=\"m37.697 21.294-13.199 7.62\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m24.498 28.914.005 15.249M26.937 30.322l.004 12.433\"/\u003e\u003c/g\u003e\u003cpath d=\"m24.503 44.163 13.203 7.628\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m37.706 51.791 13.199-7.62M37.707 48.975l10.759-6.211\"/\u003e\u003c/g\u003e\u003cpath d=\"m50.9 28.923.005 15.248M24.503 44.163 13.6 47.705M7.69 45.682l-6.641-9.136M1.049 36.546l6.635-9.14M24.498 28.914l-10.906-3.535\" class=\"bond\"/\u003e\u003cpath fill=\"#ff0d0d\" stroke=\"none\" d=\"M80.278 27.554q0 .756-.256 1.328-.256.565-.756.881-.5.315-1.244.315-.756 0-1.262-.315-.506-.316-.757-.887-.244-.572-.244-1.334 0-.75.244-1.31.251-.565.757-.881.506-.315 1.274-.315.732 0 1.232.315.5.31.756.876.256.565.256 1.327m-3.864 0q0 .923.387 1.459.393.529 1.221.529.839 0 1.22-.529.387-.536.387-1.459 0-.929-.387-1.452-.381-.524-1.208-.524-.834 0-1.227.524-.393.523-.393 1.452\" class=\"atom\"/\u003e\u003cpath stroke=\"none\" d=\"M82.472 5.459h-.72l-2.62-4.066h-.029l.029.596q.024.357.024.732v2.738h-.565V.56h.714l2.608 4.054h.029l-.018-.327-.023-.477q-.006-.262-.006-.482V.56h.577z\" class=\"atom\"/\u003e\u003cg stroke=\"none\" class=\"atom\"\u003e\u003cpath d=\"M105.24 20.098h-.72l-2.62-4.066h-.029l.029.596q.024.357.024.732v2.738h-.565v-4.899h.714l2.608 4.054h.029l-.018-.327-.023-.477q-.006-.262-.006-.482v-2.768h.577zM109.546 20.098h-.619v-2.286h-2.512v2.286h-.613v-4.899h.613v2.072h2.512v-2.072h.619zM112.051 21.588h-1.943v-.3l.772-.779q.221-.221.371-.393.154-.175.232-.339.079-.168.079-.364 0-.243-.147-.368-.143-.129-.371-.129-.214 0-.379.075-.161.075-.328.207l-.193-.243q.171-.146.393-.246.225-.1.507-.1.411 0 .65.207t.239.575q0 .229-.096.432-.093.2-.265.397-.167.196-.392.418l-.615.603v.018h1.486z\"/\u003e\u003c/g\u003e\u003cpath fill=\"#ff0d0d\" stroke=\"none\" d=\"M12.268 48.869q0 .756-.256 1.328-.256.565-.756.881-.5.315-1.244.315-.756 0-1.262-.315-.506-.316-.756-.887-.244-.572-.244-1.334 0-.75.244-1.309.25-.566.756-.881t1.274-.316q.732 0 1.232.316.5.309.756.875.256.565.256 1.327m-3.863 0q0 .923.387 1.459.393.53 1.22.53.839 0 1.22-.53.387-.536.387-1.459 0-.928-.387-1.452-.381-.524-1.208-.524-.833 0-1.226.524t-.393 1.452M12.26 24.211q0 .756-.256 1.328-.256.566-.756.881t-1.244.316q-.756 0-1.262-.316-.506-.315-.756-.887-.244-.571-.244-1.333 0-.751.244-1.31.25-.566.756-.881t1.274-.316q.732 0 1.232.316.5.309.756.875.256.565.256 1.327m-3.863 0q0 .923.387 1.459.393.53 1.22.53.84 0 1.221-.53.387-.536.387-1.459 0-.928-.387-1.452-.381-.524-1.209-.524-.833 0-1.226.524t-.393 1.452\" class=\"atom\"/\u003e\u003cpath stroke=\"#ff0d0d\" d=\"m74.573 26.009-5.238-2.353M80.65 24.585l3.743-4.227\" class=\"hi\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m77.222 3.722-5.795 1.246M99.965 17.315l-5.915-.592\" class=\"hi\"/\u003e\u003cpath stroke=\"#ff0d0d\" d=\"m13.6 47.705 5.452-1.771M7.69 45.682l-3.32-4.568M7.684 27.406l-3.317 4.57M13.592 25.379l5.453 1.768\" class=\"hi\"/\u003e\u003c/g\u003e\u003c/g\u003e\u003c/svg\u003e","Title":"3',4'-Methylenedioxyaminorex","XLogP":0.6}