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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:15:06 UTC
Update Date2025-03-24 20:40:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01526503
Frequency0.8
Structure
Chemical FormulaC7H12N2O
Molecular Mass140.095
SMILESCC(=O)N1CC2CNC2C1
InChI KeyWLZUOALEELNEDD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-acylpyrrolidines
Direct Parent n-acylpyrrolidines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,4-diazepanes
  • acetamides
  • amino acids and derivatives
  • azacyclic compounds
  • azetidines
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • tertiary carboxylic acid amides
    • Substituents
  • carbonyl group
  • 1,4-diazepane
  • amino acid or derivatives
  • n-acylpyrrolidine
  • diazepane
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • organic oxide
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • acetamide
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • carboxamide group
  • azetidine
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine