Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:11 UTC
Update Date2025-03-25 01:00:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245219
Frequency0.5
Structure
Chemical FormulaC7H12N2O
Molecular Mass140.095
SMILESCN1CC2CCN(C2)C1=O
InChI KeyHTGPYFKEZIDZSR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazepanes
Subclass 1,3-diazepanes
Direct Parent 1,3-diazepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • diazinanes
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrimidones
  • pyrrolidines
  • ureas
  • Substituents
  • 1,3-diazepane
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • pyrimidone
  • pyrimidine
  • urea
  • aliphatic heteropolycyclic compound
  • 1,3-diazinane
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound