{"Abbreviation":["3C-PEP"],"Aliases":["1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine","1-(3-chlorophenyl)-4-phenethylpiperazine","Unii-3leh2e7aeu","Chembl113621","Piperazine, 1-(3-chlorophenyl)-4-(2-phenylethyl)-","Oprea1_478370","Schembl9373313","Dtxsid501032720","Bdbm50007404","DB-146497","1-(3-Chloro-phenyl)-4-phenethyl-piperazine","Ab00084627-01"],"CAS":"147429-37-6","ChemicalClasses":["phenethylamine"],"Chirality":"achiral","Esters":[],"Formating":[],"HeavyAtomCount":21,"IUPACName":"1-(3-chlorophenyl)-4-(2-phenylethyl)piperazine","InChI":"InChI=1S/C18H21ClN2/c19-17-7-4-8-18(15-17)21-13-11-20(12-14-21)10-9-16-5-2-1-3-6-16/h1-8,15H,9-14H2","InChIKey":"NKMGWZZAFWDLFG-UHFFFAOYSA-N","MeSH Headers":[],"MolecularFormula":"C\u003csub\u003e18\u003c/sub\u003eH\u003csub\u003e21\u003c/sub\u003eClN\u003csub\u003e2\u003c/sub\u003e","MolecularWeight":"300.8 g/mol","PubChemId":2845469,"Records":{"UNII":{"Impurities":[]}},"RefChem":"1054157","RefCount":3,"RefCur":"","References":[{"Name":"Wikipedia","Urls":[{"Link":"https://en.wikipedia.org/wiki/1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine","Name":"1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine","Sub":false}]},{"Name":"Wikidata","Urls":[{"Link":"https://www.wikidata.org/wiki/Q21098955","Name":"1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine","Sub":false}]},{"Name":"PubChem","Urls":[{"Link":"https://pubchem.ncbi.nlm.nih.gov/compound/2845469","Name":"1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine","Sub":false}]},{"Name":"Common Chemistry","Urls":[{"Link":"https://commonchemistry.cas.org/detail?cas_rn=147429-37-6","Name":"1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine","Sub":false}]},{"Name":"UNII","Urls":[{"Link":"https://gsrs.ncats.nih.gov/ginas/app/ui/substances/3LEH2E7AEU","Name":"1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine","Sub":false}]},{"Name":"EPA DSSTox","Urls":[{"Link":"https://comptox.epa.gov/dashboard/chemical/details/DTXSID501032720","Name":"1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine","Sub":false}]}],"Refs":["National Center for Biotechnology Information. PubChem Compound Summary for CID 2845469, 1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine. Accessed April 8, 2026. \u003ca href=https://pubchem.ncbi.nlm.nih.gov/compound/2845469\u003ehttps://pubchem.ncbi.nlm.nih.gov/compound/2845469\u003c/a\u003e","U.S. Food and Drug Administration; National Center for Advancing Translational Sciences. 1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine. UNII: 3LEH2E7AEU. Global Substance Registration System. Accessed April 8, 2026. \u003ca href=https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3LEH2E7AEU\u003ehttps://gsrs.ncats.nih.gov/ginas/app/beta/substances/3LEH2E7AEU\u003c/a\u003e"],"SMILES":"C1CN(CCN1CCC2=CC=CC=C2)C3=CC(=CC=C3)Cl","SaltData":[],"Salts":[],"Scheduling":[],"StereoisomerData":[],"Stereoisomers":[],"Structure":"\u003csvg xmlns=\"http://www.w3.org/2000/svg\" preserveAspectRatio=\"none\" style=\"display:block\" viewBox=\"0 0 150.06 78.249\"\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 0h151v79H0z\"/\u003e\u003cg class=\"mol\"\u003e\u003cpath d=\"m80.234 54.34 13.202-7.631M93.436 46.709l.001-11.398M90.285 29.641l-10.046-5.798M80.239 23.843l-13.202 7.631M67.037 31.474l-.002 11.398M80.234 54.34l-10.046-5.798M63.881 48.543l-10.045 5.799M53.836 54.342l-13.198-7.62M40.638 46.722l-13.198 7.62\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m27.44 54.342-13.204-7.628M25.002 55.75l-10.766-6.22\"/\u003e\u003c/g\u003e\u003cpath d=\"m14.236 46.714-13.198 7.62\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m1.038 54.334.005 15.248M3.477 55.741l.004 12.434\"/\u003e\u003c/g\u003e\u003cpath d=\"m1.043 69.582 13.203 7.629\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m14.246 77.211 13.198-7.62M14.247 74.395l10.759-6.212\"/\u003e\u003c/g\u003e\u003cpath d=\"m27.44 54.342.004 15.249M96.591 29.64l10.045-5.799\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m106.636 23.841 13.216 7.606M109.077 22.432l10.771 6.199\"/\u003e\u003c/g\u003e\u003cpath d=\"m119.852 31.447 13.186-7.642\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"m133.038 23.805-.031-15.248M130.596 22.402l-.024-12.428\"/\u003e\u003c/g\u003e\u003cpath d=\"m133.007 8.557-13.165-7.519\" class=\"bond\"/\u003e\u003cg class=\"bond\"\u003e\u003cpath d=\"M119.842 1.038 106.657 8.68M119.851 3.852l-10.758 6.235\"/\u003e\u003c/g\u003e\u003cpath d=\"m106.636 23.841.021-15.161M133.038 23.805l10.263 5.901\" class=\"bond\"/\u003e\u003cpath stroke=\"none\" d=\"M95.379 33.911h-.721l-2.619-4.066h-.03l.03.595q.024.357.024.732v2.739h-.566v-4.9h.715l2.607 4.054h.03l-.018-.327-.024-.476q-.006-.262-.006-.483v-2.768h.578zM68.975 49.172h-.72l-2.62-4.066h-.03l.03.595q.024.357.024.732v2.739h-.566v-4.9h.715l2.607 4.055h.03l-.018-.328-.024-.476q-.006-.262-.006-.482v-2.769h.578z\" class=\"atom\"/\u003e\u003cpath fill=\"#1ff01f\" stroke=\"none\" d=\"M146.744 29.425q-.786 0-1.238.529-.453.524-.453 1.447 0 .911.417 1.447.423.529 1.268.529.321 0 .607-.053.292-.06.566-.143v.536q-.274.101-.566.149-.292.053-.696.053-.745 0-1.251-.309-.5-.31-.75-.875-.25-.572-.25-1.34 0-.744.268-1.31.274-.565.804-.881.53-.321 1.28-.321.78 0 1.351.286l-.244.523q-.226-.101-.506-.184-.274-.083-.607-.083m2.756 4.423h-.601v-5.215h.601z\" class=\"atom\"/\u003e\u003cpath stroke=\"#3050f8\" d=\"m93.437 35.311-.001 5.699M90.285 29.641l-5.023-2.899M67.035 42.872l.001-5.699M70.188 48.542l5.023 2.899M63.881 48.543l-5.023 2.899M96.591 29.64l5.022-2.899\" class=\"hi\"/\u003e\u003cpath stroke=\"#1ff01f\" d=\"m143.301 29.706-5.132-2.951\" class=\"hi\"/\u003e\u003c/g\u003e\u003c/g\u003e\u003c/svg\u003e","Title":"1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine","UNII":"3LEH2E7AEU","Wikidata":"Q21098955","Wikipedia":"1-(3-Chlorophenyl)-4-(2-phenylethyl)piperazine","XLogP":4.4}
