89057 <common-name>2-Chloro-N-(1,1-dimethyl-2-phenylethyl)-N-methylacetamide</common-name> <description>2-Chloro-N-(1,1-dimethyl-2-phenylethyl)-N-methylacetamide belongs to the phenethylamines, a subclass of benzene and substituted derivatives within the organic compounds. It is a member of the benzenoids superclass with the chemical formula C13H18ClNO and an average molecular weight of 239.74 g/mol.</description> <cas>2293-55-2</cas> <pubchem-id>75298</pubchem-id> <chemical-formula>C13H18ClNO</chemical-formula> <weight>239.74</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">2026-04-04T23:29:35Z</created-at> <updated-at type="dateTime">2026-08-19T01:17:46Z</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>CN(C(=O)CCl)C(C)(C)CC1=CC=CC=C1</moldb-smiles> <moldb-formula>C13H18ClNO</moldb-formula> <moldb-inchi>InChI=1/C13H18ClNO/c1-13(2,15(3)12(16)10-14)9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3</moldb-inchi> <moldb-inchikey>NDMFQZFHMQOFBT-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">239.74</moldb-average-mass> <moldb-mono-mass type="decimal">239.1076919</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.9</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>CHEM084950</chemdb-id> <dsstox-id>DTXSID30945612</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00049895</susdat-id> <iupac>2-chloro-N-methyl-N-(2-methyl-1-phenylpropan-2-yl)acetamide</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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Phenethylamines</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0177932</sync-id> <structure-inchikey>NDMFQZFHMQOFBT-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000002000000000000000000000000000000000000000000000000000000000000000000004800000000000000000800000000000000000000000000000000000000000000020001000000000000400000000000000800000010000000800000000004080000000000000000000000000000000000000000040200000800004000000000000100000000100000000020000000000000000000200200000000000080000000000000000000000000000000000000000000000000000000000000000000000010010000000000000000220000000000000000000000200000040000000000400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEAAAAIABBgBgAAAAAQMHACgAAAAD AwYAKAAAAAMECAAoAAAAAwIGAGAAAAACAhEAIAAAAAEGACAAAAAEBgBgAAAA AQMGAGAAAAABAwYAYAAAAAICBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEG QGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwELAAEAAQIgAgMoAgIEAAQFAAEG AAYHAAYIAAYJAAkKAAoLaAwLDGgMDA1oDA0OaAwOD2gMDwpoDEIBAAAABgoP Dg0MCxcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:32:28Z</structure-indexed-at> </compound>