Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID20166753

Structure

InChI Key APYDCJBHJXFOTJ-UHFFFAOYSA-N
Smiles CC1=NCCN=C1C
InChI
InChI=1S/C6H10N2/c1-5-6(2)8-4-3-7-5/h3-4H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H10N2
Molecular Weight 110.08
AlogP 0.92
Hydrogen Bond Acceptor 2.0
Polar Surface Area 24.72
Heavy Atoms 8.0

Cross References

Resources Reference
CAS NUMBER 15986-92-2
NORMAN SUSDAT
PubChem 85225
ChemSpider 76858.0