Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:47:11 UTC
Update Date2025-03-21 21:58:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00454953
Frequency3.9
Structure
Chemical FormulaC7H14N2
Molecular Mass126.1157
SMILESCC1=NCCC(C)(C)N1
InChI KeyQEHAKTWCHFGAOU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent hydropyrimidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amidines
  • azacyclic compounds
  • carboximidamides
  • hydrocarbon derivatives
  • imidolactams
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • 1,4,5,6-tetrahydropyrimidine
  • azacycle
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • hydropyrimidine
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • imidolactam