Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:42:25 UTC
Update Date2025-03-24 22:19:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01159968
Frequency1.2
Structure
Chemical FormulaC7H8N2O
Molecular Mass136.0637
SMILESc1cnc2c(c1)OCCN2
InChI KeyQQVXDMFULJVZLA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • alkyl aryl ethers
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organopnictogen compounds
  • oxacyclic compounds
  • pyridines and derivatives
  • secondary alkylarylamines
  • Substituents
  • ether
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • alkyl aryl ether
  • secondary amine
  • secondary aliphatic/aromatic amine
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • imidolactam
  • organooxygen compound
  • amine