<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">283965</id>
  <title nil="true"/>
  <common-name>N,n-dimethyl-1-(5-phenyl-1,2-oxazol-3-yl)methanamine</common-name>
  <description>N,n-dimethyl-1-(5-phenyl-1,2-oxazol-3-yl)methanamine belongs to the amines, a subclass of organonitrogen compounds within the organic compounds. It has the chemical formula C12H14N2O and an average molecular weight of 202.25 g/mol. The compound is further classified as part of the organic nitrogen compounds superclass.</description>
  <cas nil="true"/>
  <pubchem-id>13913</pubchem-id>
  <chemical-formula>C12H14N2O</chemical-formula>
  <weight>202.25</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">2026-08-27T19:34:31Z</created-at>
  <updated-at type="dateTime">2026-08-27T19:34:31Z</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)CC1=NOC(=C1)C2=CC=CC=C2</moldb-smiles>
  <moldb-formula>C12H14N2O</moldb-formula>
  <moldb-inchi>InChI=1S/C12H14N2O/c1-14(2)9-11-8-12(15-13-11)10-6-4-3-5-7-10/h3-8H,9H2,1-2H3</moldb-inchi>
  <moldb-inchikey>UWMXSCVXWHUWDH-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">202.1106131</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.9</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>CHEM279858</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,n-dimethyl-1-(5-phenyl-1,2-oxazol-3-yl)methanamine</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>CED0235865</sync-id>
  <structure-inchikey>UWMXSCVXWHUWDH-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>1800000000040000000000000000000000000000000800000000000000000000000000000002004000000020000000000800000000010000000000000000000000000000000000008800010000000000008008000000000000000000000000000000040104000000000020000000000000000000000000000000040000000800000000000000000900000000100000000000000000000000000000000000000000000080000000000000000000000000000000000000002000000000000000000000000000000000000400000000000000200080000000000000000000000000040000000000000000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������� ������`�������`������@(������@(������@(������@(������@h�������@(������@h�������@h�������@h�������@h�������@h���������������������h���h���h���h��	 	
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  <structure-indexed-at type="dateTime">2026-09-19T04:58:23Z</structure-indexed-at>
</compound>
