Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:19:15 UTC
Update Date2025-03-24 14:16:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00816748
Frequency1.8
Structure
Chemical FormulaC8H12N2
Molecular Mass136.1
SMILESCC(C)Nc1ccccn1
InChI KeyJQPJCPJUEYREHV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent secondary alkylarylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • methylpyridines
  • organopnictogen compounds
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • methylpyridine
  • secondary aliphatic/aromatic amine
  • pyridine
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • imidolactam
  • organoheterocyclic compound