<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">281327</id>
  <title nil="true"/>
  <common-name>1-carbamoyl-1-ethyl-3-(2-methylphenyl)urea</common-name>
  <description>1-carbamoyl-1-ethyl-3-(2-methylphenyl)urea belongs to the n-phenylureas, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C11H15N3O2 and an average molecular weight of 221.26 g/mol.</description>
  <cas>76267-14-6</cas>
  <pubchem-id>3059250</pubchem-id>
  <chemical-formula>C11H15N3O2</chemical-formula>
  <weight>221.26</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">2026-08-27T16:34:22Z</created-at>
  <updated-at type="dateTime">2026-08-27T16:34:22Z</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(C(=O)N)C(=O)NC1=CC=CC=C1C</moldb-smiles>
  <moldb-formula>C11H15N3O2</moldb-formula>
  <moldb-inchi>InChI=1S/C11H15N3O2/c1-3-14(10(12)15)11(16)13-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3,(H2,12,15)(H,13,16)</moldb-inchi>
  <moldb-inchikey>VMNZYLVNXJOJMN-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">221.1164267</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.5</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>CHEM277220</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>1-carbamoyl-1-ethyl-3-(2-methylphenyl)urea</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>N-phenylureas</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0233305</sync-id>
  <structure-inchikey>VMNZYLVNXJOJMN-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000000800000000010040000000000000000000000002000000000000000000800000000020000000000000000000000000000000000000000000000000000000000020200000000000000000000000000000000000010000000000000000004000000004000800000000000000000000000000000040000000800000000000000080001000000100000080000000000000000040000000000000000000080100000000000000000000000000000000000000000000000000000000000000008000000000008000002000000200000000000000008020000000000040000000000400000000000000000001000010000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������(�������(�������h��������(�������(�������h�������@(������@h�������@h�������@h�������@h�������@(�������`�������������� ��(��� �� ��(��� �	 	
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  <structure-indexed-at type="dateTime">2026-09-19T04:56:24Z</structure-indexed-at>
</compound>
