294496 <common-name>2-[4-(2,4-dimethylcyclohexyl)butylamino]ethanethiol</common-name> <description>2-[4-(2,4-dimethylcyclohexyl)butylamino]ethanethiol belongs to the amines, a subclass of organonitrogen compounds within the organic compounds. It has the formula C14H29NS and an average molecular weight of 243.45 g/mol. This compound is further classified as an organic nitrogen compound.</description> <cas nil="true"/> <pubchem-id>217536</pubchem-id> <chemical-formula>C14H29NS</chemical-formula> <weight>243.45</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">2026-08-28T10:10:05Z</created-at> <updated-at type="dateTime">2026-08-28T10:10:05Z</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>CC1CCC(C(C1)C)CCCCNCCS</moldb-smiles> <moldb-formula>C14H29NS</moldb-formula> <moldb-inchi>InChI=1S/C14H29NS/c1-12-6-7-14(13(2)11-12)5-3-4-8-15-9-10-16/h12-16H,3-11H2,1-2H3</moldb-inchi> <moldb-inchikey>PTFMBDDBSWDCKR-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">243.2020711</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.6</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>CHEM290389</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>2-[4-(2,4-dimethylcyclohexyl)butylamino]ethanethiol</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" nil="true"/> <sync-id>CED0245975</sync-id> <structure-inchikey>PTFMBDDBSWDCKR-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>804000000000000000000000000000000000240000000000000000000000000200000000000000000000000000000000000000000000000000000000000200008000080000200008001000000000000000000000000010000000000000008000000000000004100000020000000000000000000800100000000040000000000000000040000880000000000000000000000000000000000800040024000000000000000000000000000000001000000000000000000000000000000000000000000000000000000000000000000000000000000000000000002000000000100000100000010000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEAAAAIABBgBgAAAAAQMGAGAAAAAD AQYAYAAAAAICBgBgAAAAAgIGAGAAAAADAQYAYAAAAAMBBgBgAAAAAgIGAGAA AAABAwYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBwBgAAAAAgEG AGAAAAACAgYAYAAAAAICEABgAAAAAQELAAEAAQIAAgMAAwQABAUABQYABQcA BAgACAkACQoACgsACwwADA0ADQ4ADg8ABgEAQgEAAAAGAQYFBAMCFwQAAAAA AAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:06:05Z</structure-indexed-at> </compound>