Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:08 UTC
Update Date2025-03-21 18:01:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00034049
Frequency106.0
Structure
Chemical FormulaC12H17N
Molecular Mass175.1361
SMILESc1ccc(CC2CCCCN2)cc1
InChI KeyITXCORRITGNIHP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpiperidines
Subclass benzylpiperidines
Direct Parent 2-benzylpiperidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzene and substituted derivatives
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • monocyclic benzene moiety
  • 2-benzylpiperidine
  • aromatic heteromonocyclic compound
  • azacycle
  • secondary amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine