Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:43:15 UTC
Update Date2025-03-24 21:18:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01738081
Frequency0.7
Structure
Chemical FormulaC8H12N2
Molecular Mass136.1
SMILESCCc1cnc(N)c(C)c1
InChI KeyCDILKPQKWUSZGC-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
  • imidolactams
  • methylpyridines
  • organopnictogen compounds
  • primary amines
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • methylpyridine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • 2-halopyridine
  • organic nitrogen compound
  • imidolactam
  • amine