Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID90189035

Structure

InChI Key OSDDDHPYSNZBPF-UHFFFAOYSA-N
Smiles N#CCCCN1CCCC1
InChI
InChI=1/C8H14N2/c9-5-1-2-6-10-7-3-4-8-10/h1-4,6-8H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H14N2
Molecular Weight 138.12
AlogP 1.39
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 3.0
Polar Surface Area 27.03
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 35543-25-0
NORMAN SUSDAT
PubChem 118838