Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:18:07 UTC
Update Date2025-03-21 20:52:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00385645
Frequency4.8
Structure
Chemical FormulaC8H14N2
Molecular Mass138.1157
SMILESCNCCc1ccn(C)c1
InChI KeyBYKZMEGVLBGWBX-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
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-methylpyrroles
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • n-methylpyrrole
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • substituted pyrrole
  • secondary amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine