Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 22E509663B
EPA CompTox DTXSID90861728

Structure

InChI Key NNWUEBIEOFQMSS-UHFFFAOYSA-N
Smiles N1CCCCC1C
InChI
InChI=1/C6H13N/c1-6-4-2-3-5-7-6/h6-7H,2-5H2,1H3

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 109-05-7
NORMAN SUSDAT
FDA SRS 22E509663B
PubChem 7974