Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:12 UTC
Update Date2025-03-25 00:55:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02213401
Frequency0.5
Structure
Chemical FormulaC14H21FN2
Molecular Mass236.1689
SMILESCN(C)CCC1(c2ccc(F)cc2)CCCN1
InChI KeyVQOSBWLNZBECHE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass phenylpyrrolidines
Direct Parent phenylpyrrolidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl fluorides
  • azacyclic compounds
  • dialkylamines
  • fluorobenzenes
  • hydrocarbon derivatives
  • organofluorides
  • organopnictogen compounds
  • pyrroles
  • trialkylamines
  • Substituents
  • aryl fluoride
  • secondary aliphatic amine
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • azacycle
  • organofluoride
  • 2-phenylpyrrolidine
  • tertiary aliphatic amine
  • secondary amine
  • organohalogen compound
  • aryl halide
  • fluorobenzene
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • halobenzene
  • amine
  • tertiary amine