141109 <common-name>Doxpicomine</common-name> <description>Doxpicomine is an organic nitrogen compound with the formula C12H18N2O2 and an average molecular weight of 222.29 g/mol. Doxpicomine belongs to the amines, a subclass of organonitrogen compounds within the organic compounds.</description> <cas>62904-71-6</cas> <pubchem-id>71587215</pubchem-id> <chemical-formula>C12H18N2O2</chemical-formula> <weight>222.28</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">2026-04-15T17:21:23Z</created-at> <updated-at type="dateTime">2026-08-18T19:38:34Z</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>DB20400</drugbank-id> <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>CN(C)[C@H](C1COCOC1)C1=CN=CC=C1</moldb-smiles> <moldb-formula>C12H18N2O2</moldb-formula> <moldb-inchi>InChI=1S/C12H18N2O2/c1-14(2)12(10-4-3-5-13-6-10)11-7-15-9-16-8-11/h3-6,11-12H,7-9H2,1-2H3/t12-/m0/s1</moldb-inchi> <moldb-inchikey>SMZVRZPJXBGNFT-LBPRGKRZSA-N</moldb-inchikey> <moldb-average-mass type="decimal">222.288</moldb-average-mass> <moldb-mono-mass type="decimal">222.136827828</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>0.6</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>CHEM137002</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>(1R)-1-(1,3-dioxan-5-yl)-N,N-dimethyl-1-pyridin-3-ylmethanamine</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 nitrogen compounds</superklass> <klass>Organonitrogen compounds</klass> <subklass>Amines</subklass> <paper-count type="integer">3</paper-count> <sync-id>CED0046894</sync-id> <structure-inchikey>SMZVRZPJXBGNFT-LBPRGKRZSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000000000000000000000000004002000000000000000000000000000000400000000000000002000000020000004000000000000000000001000000000000040000000000000000000800000000000000000000000000000000000000000000000000000004000000000020000000000000000000000100000100040001000800000000000000000100000000000000000000000000000000000000000000004000400080000000000000040000000000000000000000100000000000420001000000000000000000000000000000000000300000000000000000000000004002040000000000010000020000000200000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`������� ������`������ 4��������`�������`������� ������`������� ������`������@(������@h�������@(������@h�������@h�������@h�������������������������������� �� � �h���h�� h� �h���h� ��� h�B��������� ���� �� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:51:51Z</structure-indexed-at> </compound>