Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:39 UTC
Update Date2025-03-25 00:58:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02230183
Frequency0.5
Structure
Chemical FormulaC14H19FN2O
Molecular Mass250.1481
SMILESCN(C)CC(=O)N1CCCC1c1ccc(F)cc1
InChI KeyOQWDDDHKTGFDNZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass phenylpyrrolidines
Direct Parent phenylpyrrolidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • aryl fluorides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • fluorobenzenes
  • hydrocarbon derivatives
  • n-acylpyrrolidines
  • organic oxides
  • organofluorides
  • organopnictogen compounds
  • pyrroles
  • tertiary carboxylic acid amides
  • trialkylamines
  • Substituents
  • aryl fluoride
  • monocyclic benzene moiety
  • carbonyl group
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • n-acylpyrrolidine
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • organohalogen compound
  • fluorobenzene
  • organic oxide
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • tertiary amine
  • azacycle
  • organofluoride
  • 2-phenylpyrrolidine
  • tertiary aliphatic amine
  • carboxamide group
  • aryl halide
  • organic oxygen compound
  • pyrrole
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • halobenzene
  • amine
  • organooxygen compound