Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:20:08 UTC
Update Date2025-03-21 23:14:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00674648
Frequency2.3
Structure
Chemical FormulaC8H16N2
Molecular Mass140.1313
SMILESCN1C2CCC1C(CN)C2
InChI KeyHSXGDXMSSVOIKV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • aliphatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • amine
  • tertiary amine