Keyword(s): Human Metabolites
Molecule Category Free-form
UNII K863RVK4W7
EPA CompTox DTXSID90197110

Structure

InChI Key FDSRLFIEZWQEEU-UHFFFAOYSA-N
Smiles N#CCCCCN1CCCCC1
InChI
InChI=1/C10H18N2/c11-7-3-1-4-8-12-9-5-2-6-10-12/h1-6,8-10H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H18N2
Molecular Weight 166.15
AlogP 2.17
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 27.03
Heavy Atoms 12.0

Cross References

Resources Reference
CAS NUMBER 4734-49-0
NORMAN SUSDAT
FDA SRS K863RVK4W7
PubChem 78472