Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:53:51 UTC
Update Date2025-03-21 20:06:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00328666
Frequency5.9
Structure
Chemical FormulaC7H12ClN
Molecular Mass145.0658
SMILESCN1C2CCC1C(Cl)C2
InChI KeyHZIKTTSBMIBXLL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • alkyl chlorides
  • azacyclic compounds
  • hydrocarbon derivatives
  • organochlorides
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • azacycle
  • n-alkylpyrrolidine
  • alkyl chloride
  • organochloride
  • tertiary aliphatic amine
  • organohalogen compound
  • aliphatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine