336681 <common-name>N-[4-(3-oxo-4-propan-2-yl-2,4-dihydro-1h-isoquinolin-1-yl)phenyl]-2-(propan-2-ylamino)acetamide</common-name> <description>N-[4-(3-oxo-4-propan-2-yl-2,4-dihydro-1h-isoquinolin-1-yl)phenyl]-2-(propan-2-ylamino)acetamide is a chemical compound with the formula C23H29N3O2. It has an average molecular weight of 379.50 g/mol.</description> <cas>54087-41-1</cas> <pubchem-id>40986</pubchem-id> <chemical-formula>C23H29N3O2</chemical-formula> <weight>379.5</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-08-30T19:13:22Z</created-at> <updated-at type="dateTime">2026-08-30T19:13:22Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>CC(C)C1C2=CC=CC=C2C(NC1=O)C3=CC=C(C=C3)NC(=O)CNC(C)C</moldb-smiles> <moldb-formula>C23H29N3O2</moldb-formula> <moldb-inchi>InChI=1S/C23H29N3O2/c1-14(2)21-18-7-5-6-8-19(18)22(26-23(21)28)16-9-11-17(12-10-16)25-20(27)13-24-15(3)4/h5-12,14-15,21-22,24H,13H2,1-4H3,(H,25,27)(H,26,28)</moldb-inchi> <moldb-inchikey>PWVTZSFIYJSYCX-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">379.2259772</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.3</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM332574</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>N-[4-(3-oxo-4-propan-2-yl-2,4-dihydro-1h-isoquinolin-1-yl)phenyl]-2-(propan-2-ylamino)acetamide</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Organoheterocyclic compounds</superklass> <klass>Tetrahydroisoquinolines</klass> <subklass>1-phenyltetrahydroisoquinolines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0287139</sync-id> <structure-inchikey>PWVTZSFIYJSYCX-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000010004000000000800000000000000000000000000100000000000000040a00001000040020000000000000100000000000000000000000000000000000000000000000000000000000000000000020000000000020000000000000000000020100010000000010000000040010041000020000000000000000000000101820000040000400800000204000000080000000000100000000000000000001000000000000000000000000080000000000020080000040000000000000000000000000400000000000000000000000000000000000000000000200000000000010008000000000000040000000000400000000000000000000000000020000</structure-fingerprint> 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