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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:46:00 UTC
Update Date2025-03-24 14:02:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00737004
Frequency2.1
Structure
Chemical FormulaC5H11N3
Molecular Mass113.0953
SMILESCC1=NCC(CN)N1
InChI KeyBNEMQQXJCVQTOB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidolactams
Subclass imidolactams
Direct Parent imidolactams
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amidines
  • azacyclic compounds
  • carboximidamides
  • hydrocarbon derivatives
  • imidazolines
  • monoalkylamines
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • 2-imidazoline
  • imidazoline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • imidolactam