Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:21:36 UTC
Update Date2025-03-21 18:37:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00114222
Frequency23.1
Structure
Chemical FormulaC10H14N2
Molecular Mass162.1157
SMILESc1ccc(C2CCCCN2)nc1
InChI KeyKXRQQPIHUMSJSS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass bipyridines and oligopyridines
Direct Parent bipyridines and oligopyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • piperidines
  • Substituents
  • secondary aliphatic amine
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • bipyridine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • piperidine
  • amine