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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:48:04 UTC
Update Date2025-03-25 00:25:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01318493
Frequency1.0
Structure
Chemical FormulaC8H14N2
Molecular Mass138.1157
SMILESCc1ccn(C)c1CCN
InChI KeyOODSZRPMDRHDEY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrroles
Subclass substituted pyrroles
Direct Parent substituted pyrroles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • n-methylpyrroles
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • n-methylpyrrole
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • substituted pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound