289772 <common-name>Diethyl-methyl-[2-(1-methylpyridin-1-ium-2-yl)ethyl]azanium</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id>202012</pubchem-id> <chemical-formula>C13H24N2+2</chemical-formula> <weight>208.34</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">2026-08-28T03:19:12Z</created-at> <updated-at type="dateTime">2026-08-28T03:19:12Z</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[N+](C)(CC)CCC1=CC=CC=[N+]1C</moldb-smiles> <moldb-formula>C13H24N2+2</moldb-formula> <moldb-inchi>InChI=1S/C13H24N2/c1-5-15(4,6-2)12-10-13-9-7-8-11-14(13)3/h7-9,11H,5-6,10,12H2,1-4H3/q+2</moldb-inchi> <moldb-inchikey>ZCJNLFLPYOFCDS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">208.1939488</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.1</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>CHEM285665</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>Diethyl-methyl-[2-(1-methylpyridin-1-ium-2-yl)ethyl]azanium</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>Pyridines and derivatives</klass> <subklass>Methylpyridines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0241455</sync-id> <structure-inchikey>ZCJNLFLPYOFCDS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000800000000000000000000000000000000000000000002000000400000000000000000000002200000000001200200000000000000000000000002000000000008000000000040010000000000000000000000000000000000000000000000000000000040000000000020008000001000000000000040000000800000000000000000000000000100000000041000000000000000000000000000000000080000000000000000002000000000000000800000000000000000000000000000000000000000000000000000000200000000000000000000000000000040000000008000000000000000000000000000000000</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�B������ �� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:02:35Z</structure-indexed-at> </compound>