{"Abbreviation":["IBG"],"Aliases":["Ibogainalog","9-methoxy-3-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole","Nci60_014750","Methyl 3-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indol-9-yl ether hydroiodide","802581-10-8"],"ChEMBL":"CHEMBL2009371","ChemicalClasses":["hexahydroazepinoindole"],"Chirality":"achiral","DurationOfAction":"","EliminationHalfLife":"","Esters":[],"Formating":[],"HeavyAtomCount":17,"IUPACName":"9-methoxy-3-methyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole","InChI":"InChI=1S/C14H18N2O/c1-16-7-5-11-12-9-10(17-2)3-4-13(12)15-14(11)6-8-16/h3-4,9,15H,5-8H2,1-2H3","InChIKey":"RVVJOBLZASPMDJ-UHFFFAOYSA-N","MolecularFormula":"C\u003csub\u003e14\u003c/sub\u003eH\u003csub\u003e18\u003c/sub\u003eN\u003csub\u003e2\u003c/sub\u003eO","MolecularWeight":"230.31 g/mol","PubChemId":370423,"RefCount":2,"RefCur":"","References":[{"Name":"Wikipedia","Urls":[{"Link":"https://en.wikipedia.org/wiki/Ibogainalog","Name":"Ibogainalog","Sub":false}]},{"Name":"Wikidata","Urls":[{"Link":"https://www.wikidata.org/wiki/Q131438016","Name":"Ibogainalog","Sub":false}]},{"Name":"PubChem","Urls":[{"Link":"https://pubchem.ncbi.nlm.nih.gov/compound/370423","Name":"Ibogainalog","Sub":false}]},{"Name":"ChEMBL","Urls":[{"Link":"https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2009371","Name":"Ibogainalog","Sub":false}]}],"Refs":["National Center for Biotechnology Information. PubChem Compound Summary for CID 370423, Ibogainalog. Accessed October 10, 2025. \u003ca href=https://pubchem.ncbi.nlm.nih.gov/compound/370423\u003ehttps://pubchem.ncbi.nlm.nih.gov/compound/370423\u003c/a\u003e"],"SMILES":"CN1CCC2=C(CC1)NC3=C2C=C(C=C3)OC","SaltData":[],"Salts":[],"Scheduling":[],"StereoisomerData":[],"Stereoisomers":[],"Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 116.026 54.486\"\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 0h117v55H0z\"/\u003e\u003cg class=\"mol\"\u003e\u003cpath d=\"m115.024 14.785-11.221 3.646M97.622 16.452l-7.623-7.973M89.999 8.479 74.82 9.845M74.82 9.845l-8.396 12.719\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m71.134 37.058-4.71-14.494M68.267 36.126l-3.614-11.124\"/\u003e\u003c/g\u003e\u003cpath d=\"m71.134 37.058 14.268 5.355M85.402 42.413l13.083-7.817M100.011 23.331l-1.526 11.265M71.134 37.058l-9.256 6.725M55.731 43.783l-9.256-6.725\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m46.475 37.058 4.709-14.494M44.591 34.965l3.839-11.816\"/\u003e\u003c/g\u003e\u003cpath d=\"M66.424 22.564h-15.24M51.184 22.564 40.987 11.238\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"M40.987 11.238 26.08 14.407M40.117 13.916l-12.153 2.583\"/\u003e\u003c/g\u003e\u003cpath d=\"m26.08 14.407-4.71 14.494\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m21.37 28.901 10.198 11.325M24.124 28.315l8.314 9.233\"/\u003e\u003c/g\u003e\u003cpath d=\"m46.475 37.058-14.907 3.168M26.08 14.407 18.537 6.03M12.253 3.852.975 6.25\" class=\"bond\"/\u003e\u003cpath stroke=\"none\" d=\"M102.471 21.944h-.72l-2.62-4.066h-.029l.029.595q.024.357.024.732v2.739h-.565v-4.9h.714l2.607 4.054h.03l-.018-.327q-.012-.22-.023-.476-.006-.262-.006-.482v-2.769h.577z\" class=\"atom\"/\u003e\u003cg stroke=\"none\" class=\"atom\"\u003e\u003cpath d=\"M60.745 48.465h-.72l-2.62-4.066h-.03l.03.596q.024.357.024.732v2.738h-.566v-4.899h.715l2.607 4.054h.03l-.018-.327-.024-.477q-.006-.262-.006-.482v-2.768h.578zM60.608 53.926h-.619V51.64h-2.512v2.286h-.614v-4.899h.614v2.072h2.512v-2.072h.619z\"/\u003e\u003c/g\u003e\u003cpath fill=\"#ff0d0d\" stroke=\"none\" d=\"M18.141 3.078q0 .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-.881T15.897.56q.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-.53.386-.536.386-1.459 0-.929-.386-1.452-.381-.524-1.209-.524-.833 0-1.226.524-.393.523-.393 1.452\" class=\"atom\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m103.803 18.431 5.61-1.823M97.622 16.452l-3.812-3.986M100.011 23.331l-.763 5.632M61.878 43.783l4.628-3.362M55.731 43.783l-4.628-3.362\" class=\"hi\"/\u003e\u003cpath stroke=\"#ff0d0d\" d=\"m18.537 6.03 3.771 4.189M12.253 3.852 6.614 5.051\" class=\"hi\"/\u003e\u003c/g\u003e\u003c/g\u003e\u003c/svg\u003e","Title":"Ibogainalog","Wikidata":"Q131438016","Wikipedia":"Ibogainalog","XLogP":2.4}