Keyword(s): Human Metabolites
Molecule Category Free-form
UNII C6EG1921F4
EPA CompTox DTXSID80955362

Structure

InChI Key ZEBFPAXSQXIPNF-UHFFFAOYSA-N
Smiles N1C(C)CCC1C
InChI
InChI=1/C6H13N/c1-5-3-4-6(2)7-5/h5-7H,3-4H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H13N
Molecular Weight 99.1
AlogP 1.15
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Polar Surface Area 12.03
Heavy Atoms 7.0

Cross References

Resources Reference
CAS NUMBER 3378-71-0
NORMAN SUSDAT
FDA SRS C6EG1921F4
PubChem 96034