<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">303915</id>
  <title nil="true"/>
  <common-name>N-(4-chloro-2-methylphenyl)-2-[2-(diethylamino)ethyl-methylamino]acetamide</common-name>
  <description>N-(4-chloro-2-methylphenyl)-2-[2-(diethylamino)ethyl-methylamino]acetamide belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. This organic acid derivative has the chemical formula C16H26ClN3O and an average molecular weight of 311.80 g/mol.</description>
  <cas nil="true"/>
  <pubchem-id>53890</pubchem-id>
  <chemical-formula>C16H26ClN3O</chemical-formula>
  <weight>311.8</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">2026-08-28T21:22:10Z</created-at>
  <updated-at type="dateTime">2026-08-28T21:22:10Z</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>CCN(CC)CCN(C)CC(=O)NC1=C(C=C(C=C1)Cl)C</moldb-smiles>
  <moldb-formula>C16H26ClN3O</moldb-formula>
  <moldb-inchi>InChI=1S/C16H26ClN3O/c1-5-20(6-2)10-9-19(4)12-16(21)18-15-8-7-14(17)11-13(15)3/h7-8,11H,5-6,9-10,12H2,1-4H3,(H,18,21)</moldb-inchi>
  <moldb-inchikey>MSHDXLUGIJZMJS-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">311.1764402</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>CHEM299808</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>N-(4-chloro-2-methylphenyl)-2-[2-(diethylamino)ethyl-methylamino]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>Organic acids and derivatives</superklass>
  <klass>Carboxylic acids and derivatives</klass>
  <subklass>Amino acids, peptides, and analogues</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0255082</sync-id>
  <structure-inchikey>MSHDXLUGIJZMJS-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000800000000010000000000400008000000080000000100008000002000000000000000000000000000000000000000000000000000000000000000000400000000000000800000020000000000000000000000000000000000000010080000000000000104000000000000800000000000000000000000000000040000000000000000000000080100000020000000080080000000000000040000000000000000000080100000000000020800000000000000000000010040000000000000000000000000000000010000000002000000200000000000000008000000000800040000000000400000009000000040000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>500000000902060080000100010820000000040000052000003420400200000c4002085400800000000041080080000004200025808c30010000743000a04080c6110400020004100090108000620000000405805000013240400422000208000c200406004002000000000054140000200080500101c0047118000002310002004000180ce08008080202040a2c0008111c0812444014820000080000400080804300000010c00000000940057c27100ac000008a41084010000200084002100010028404400012018000040405028000000000420040000d000000080001000000001012010000000000005012200000100030804200060008008050000406</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������`�������`�������`�������`������� ������`�������`�������(�������(�������h�������@(������@(������@h�������@(������@h�������@h�������� ������`�������������������������������	�	
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  <structure-indexed-at type="dateTime">2026-09-19T05:13:07Z</structure-indexed-at>
</compound>
