296413 <common-name>2-methyl-4-(morpholine-4-carbonyl)isoquinolin-1-one</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>3073396</pubchem-id> <chemical-formula>C15H16N2O3</chemical-formula> <weight>272.3</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">2026-08-28T12:33:53Z</created-at> <updated-at type="dateTime">2026-08-28T12:33:53Z</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>CN1C=C(C2=CC=CC=C2C1=O)C(=O)N3CCOCC3</moldb-smiles> <moldb-formula>C15H16N2O3</moldb-formula> <moldb-inchi>InChI=1S/C15H16N2O3/c1-16-10-13(15(19)17-6-8-20-9-7-17)11-4-2-3-5-12(11)14(16)18/h2-5,10H,6-9H2,1H3</moldb-inchi> <moldb-inchikey>NPHAJQZQROIFCT-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">272.1160924</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.3</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>CHEM292306</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>2-methyl-4-(morpholine-4-carbonyl)isoquinolin-1-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>Organoheterocyclic compounds</superklass> <klass>Isoquinolines and derivatives</klass> <subklass>Isoquinolones and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0247814</sync-id> <structure-inchikey>NPHAJQZQROIFCT-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>100000000000000000000000000000000000000000000000000000001000000000000000100020000000000020000000000000000000000000800000000080001000000000000000000000000000000020800000000000000000080000000000000000010000000000080000000000000000020102020000000000000000000000000040000000800000000000004000000000000100000000000000000000000000020000000000040100080000044000000040000000008000008000000000000000040000000000000000000000000000000000000000000200000000000000000000000000000040000000000400000000000000000100004000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`������@(������@h�������@(������@(������@h�������@h�������@h�������@h�������@(������@(�������(�������(�������(�������(�������`�������`������� ������`�������`�����������h���h���h���h���h���h���h�� h� h� �(��� � (��� ��������������� �h� �h����B������ �������� ������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:07:38Z</structure-indexed-at> </compound>