303288 <common-name>N-[2-(diethylamino)ethyl]-2-(2-methyl-5-nitro-1,3-benzodioxol-2-yl)acetamide</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>39814</pubchem-id> <chemical-formula>C16H23N3O5</chemical-formula> <weight>337.37</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">2026-08-28T20:31:08Z</created-at> <updated-at type="dateTime">2026-08-28T20:31:08Z</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>CCN(CC)CCNC(=O)CC1(OC2=C(O1)C=C(C=C2)[N+](=O)[O-])C</moldb-smiles> <moldb-formula>C16H23N3O5</moldb-formula> <moldb-inchi>InChI=1S/C16H23N3O5/c1-4-18(5-2)9-8-17-15(20)11-16(3)23-13-7-6-12(19(21)22)10-14(13)24-16/h6-7,10H,4-5,8-9,11H2,1-3H3,(H,17,20)</moldb-inchi> <moldb-inchikey>QMFWKFVBWQSQEE-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">337.1637708</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.8</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>CHEM299181</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-[2-(diethylamino)ethyl]-2-(2-methyl-5-nitro-1,3-benzodioxol-2-yl)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>Benzodioxoles</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0254484</sync-id> <structure-inchikey>QMFWKFVBWQSQEE-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>4000000000800000080000000000000000000004000000000000100000000202000000000000000000000000000040000000000000000000000000000000000000000000080400000800000020801000000000001000000000400000000000010000000200000000104000040000000800000000000000000000000031000048000000000000000000000080000000001000000000000000000024200000000008000000000000080000000000000000000000000000000000000000000000000000000020000000000000000040000000000000000200000000000000420000000000000040000000400400000801001000040000000000000000</structure-fingerprint> <structure-pattern-fingerprint>5030000009328600800001500128a000000014400105200000342070822008cc44020050138000000000410800800000042000a5808c32010200647100a04000c61104001298064000901050006202000804058051211a3240000522402219400c2805270048820960009000d5b40003a08680500101e0047198022002110003504000184ff0821818060240192c0008391c8c1244421402002888002040808400c330001010c00002001968057d25100ac00001894108401820421008400212a01000a404c02032018100041501038004010000020050200d0082040800030090104810088000000000000351122084001000309042000e0008918050400406</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`�������`�������`�������`�������h��������(�������(�������`������� ������(������@(������@(�������(������@h�������@(������@h�������@h������� *��������(������ *���ÿ����`����������������������������� � (�� � ������ �h��� ��h���h���h���h��� ��(��� ������� h�B������� ������� �����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:12:40Z</structure-indexed-at> </compound>