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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:26:26 UTC
Update Date2025-03-21 22:18:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00547913
Frequency3.0
Structure
Chemical FormulaC7H10N2
Molecular Mass122.0844
SMILESCc1cnc(C)c(N)c1
InChI KeyOQLYLAOKFUUBBI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary amines
  • pyridines and derivatives
    • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • 2-halopyridine
  • organic nitrogen compound
  • amine