365044 <common-name>7,7-dimethyl-1,5,6,8-tetrahydroimidazo[4,5-c]azepin-4-one</common-name> <description>7,7-dimethyl-1,5,6,8-tetrahydroimidazo[4,5-c]azepin-4-one is a chemical compound with the formula C9H13N3O. It has an average molecular weight of 179.22 g/mol.</description> <cas nil="true"/> <pubchem-id>125512871</pubchem-id> <chemical-formula>C9H13N3O</chemical-formula> <weight>179.22</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">2026-09-01T15:26:57Z</created-at> <updated-at type="dateTime">2026-09-01T15:26:57Z</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>CC1(CC2=C(C(=O)NC1)N=CN2)C</moldb-smiles> <moldb-formula>C9H13N3O</moldb-formula> <moldb-inchi>InChI=1S/C9H13N3O/c1-9(2)3-6-7(12-5-11-6)8(13)10-4-9/h5H,3-4H2,1-2H3,(H,10,13)(H,11,12)</moldb-inchi> <moldb-inchikey>HIYPGLOIGMKOTC-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">179.105862</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.9</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>CHEM360937</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>7,7-dimethyl-1,5,6,8-tetrahydroimidazo[4,5-c]azepin-4-one</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>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0315004</sync-id> <structure-inchikey>HIYPGLOIGMKOTC-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400000000000000020000000000000000000000000000000020140000000000002000000000000000010000000000000000000000000000000000000000000000000020000008000000044000000000000000000000020000002000000000000000000000020008000000000000000000000000000048000000000000200000000000000000000000000000000000000020000000000000000100000000080000000000000000080800000100000000000400000000000000000000000000080040000000000000000000000000000000000000000000000000002040000000000000000000000000000000000000000010</structure-fingerprint> <structure-pattern-fingerprint>500000000102060080000000012820000090040001052004002420408200080c5602005002800000000001080480008004201004808c10010002443000a0400084110408001004800090100000620200000004905221103a40000462002008000d2804020048022020000010d0100200200680320109c0043118282002100002004000184c400000880012000c0800283104001244401402000008802000008400c30000000040000a000940052c211002c04000810108001c804210084002000000008404002a130080000404010280840008000240502005000204084001000010089002010004000000114158200000100010004000080000008850000006</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ���������������� �������€���`������� ������`������@(������@(�������(�������(�������h��������`������@(������@h�������@8��������`�����������������h��� ��(��� ���� h� h� �h���������h�B������������� ��� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T06:01:14Z</structure-indexed-at> </compound>