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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:28 UTC
Update Date2025-03-21 18:01:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00034841
Frequency102.9
Structure
Chemical FormulaC16H19ClN2
Molecular Mass274.1237
SMILESCN(C)CCC(c1cccc(Cl)c1)c1ccccn1
InChI KeyGICAXSWXDGMXAH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pheniramines
Direct Parent pheniramines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • aryl chlorides
  • azacyclic compounds
  • chlorobenzenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • organochlorides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • aryl chloride
  • chlorobenzene
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • pheniramine
  • azacycle
  • organochloride
  • heteroaromatic compound
  • tertiary aliphatic amine
  • methylpyridine
  • organohalogen compound
  • aryl halide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • 2-halopyridine
  • organic nitrogen compound
  • halobenzene
  • amine
  • tertiary amine