333659 <common-name>Trimethyl-[(1,1,3,6-tetramethyl-4-phenyl-4-propanoyloxypiperidin-1-ium-3-yl)methyl]azanium</common-name> <description>Trimethyl-[(1,1,3,6-tetramethyl-4-phenyl-4-propanoyloxypiperidin-1-ium-3-yl)methyl]azanium is a compound with the formula C22H38N2O2+2. It has an average molecular weight of 362.50 g/mol.</description> <cas nil="true"/> <pubchem-id>206908</pubchem-id> <chemical-formula>C22H38N2O2+2</chemical-formula> <weight>362.5</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">2026-08-30T15:10:36Z</created-at> <updated-at type="dateTime">2026-08-30T15:10:36Z</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>CCC(=O)OC1(CC([N+](CC1(C)C[N+](C)(C)C)(C)C)C)C2=CC=CC=C2</moldb-smiles> <moldb-formula>C22H38N2O2+2</moldb-formula> <moldb-inchi>InChI=1S/C22H38N2O2/c1-9-20(25)26-22(19-13-11-10-12-14-19)15-18(2)24(7,8)17-21(22,3)16-23(4,5)6/h10-14,18H,9,15-17H2,1-8H3/q+2</moldb-inchi> <moldb-inchikey>RYIOOJJMERPRFX-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">362.2933285</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.3</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>CHEM329552</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>Trimethyl-[(1,1,3,6-tetramethyl-4-phenyl-4-propanoyloxypiperidin-1-ium-3-yl)methyl]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>Piperidines</klass> <subklass>Phenylpiperidines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0284139</sync-id> <structure-inchikey>RYIOOJJMERPRFX-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000400000000000000000000000000000000000000000002000801000000000000000004000002000000000000000000000800000000000008000000000000000008000020000001000500000000000004000008000000010000000000002000000000200000124004000000000000000000100000000048000000800000000000000040000000000100000000000000000020000000040000000000000000082000000000000000000000000000000000000000000000000040010000000100000002000000000000000000004202000000000000000000000020000040000000800400000000000001000000040000200000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAaAAAAGwAAAIABBgBgAAAAAQMGAGAAAAAC AgYAKAAAAAMECAAoAAAAAwIIACgAAAADAgYAIAAAAAQGAGAAAAACAgYAYAAA AAMBByAiAAAAAQQGAGAAAAACAgYAIAAAAAQGAGAAAAABAwYAYAAAAAICByAi AAAAAQQGAGAAAAABAwYAYAAAAAEDBgBgAAAAAQMGAGAAAAABAwYAYAAAAAED BgBgAAAAAQMGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQZA aAAAAAMDAQZAaAAAAAMDAQsAAQABAgACAygCAgQgBAUABQYABgcABwgACAkA CQoACgsACgwADA0ADQ4ADQ8ADRAACBEACBIABxMABRQAFBVoDBUWaAwWF2gM FxhoDBgZaAwKBQAZFGgMQgIAAAAGBgcICQoFBhUWFxgZFBcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:35:42Z</structure-indexed-at> </compound>