317646 <common-name>9-(2-phenylethyl)-9-azatricyclo[6.2.2.02,7]dodeca-2,4,6-triene</common-name> <description>9-(2-phenylethyl)-9-azatricyclo[6.2.2.02,7]dodeca-2,4,6-triene is a chemical compound with the formula C19H21N. It has an average molecular weight of 263.40 g/mol.</description> <cas nil="true"/> <pubchem-id>3047634</pubchem-id> <chemical-formula>C19H21N</chemical-formula> <weight>263.4</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">2026-08-29T15:49:27Z</created-at> <updated-at type="dateTime">2026-08-29T15:49:27Z</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>C1CC2C3=CC=CC=C3C1CN2CCC4=CC=CC=C4</moldb-smiles> <moldb-formula>C19H21N</moldb-formula> <moldb-inchi>InChI=1S/C19H21N/c1-2-6-15(7-3-1)12-13-20-14-16-10-11-19(20)18-9-5-4-8-17(16)18/h1-9,16,19H,10-14H2</moldb-inchi> <moldb-inchikey>ZRIDUFNUJMZLAH-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">263.1673997</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.1</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>CHEM313539</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>9-(2-phenylethyl)-9-azatricyclo[6.2.2.02,7]dodeca-2,4,6-triene</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>Tetrahydroisoquinolines</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0268460</sync-id> <structure-inchikey>ZRIDUFNUJMZLAH-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>1000800000000000000000000000000000000000000000000000000000100000000000000000100804000000000000800000000000000000000000000000000000000000000000000000000000000000000000001000000000000000000000000000000000000000000000020100000000020000000000101008040000200000800000000000004000000000000100000000001000000000000000008004000000000000080000000000000000000000000000000000000000000000000000000000000000002000000000000000000000000220000000000200000000000000000040000000000000000000000000004000800002000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAUAAAAFwAAAIABBgBgAAAAAgIGAGAAAAAC AgYAYAAAAAMBBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEG QGgAAAADAwEGQCgAAAADBAYAYAAAAAMBBgBgAAAAAgIHACAAAAADBgBgAAAA AgIGAGAAAAACAgZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMB BkBoAAAAAwMBBkBoAAAAAwMBCwABAAECAAIDAAMEaAwEBWgMBQZoDAYHaAwH CGgMCAkACQoACgsACwwADA0ADQ4ADg9oDA8QaAwQEWgMERJoDBITaAwJAAAL AgAIA2gMEw5oDEIFAAAABgAJCAMCAQYACQoLAgEGBAUGBwgDBg8QERITDgYK CwIDCAkXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:23:25Z</structure-indexed-at> </compound>