Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 0VCF90A5FP
EPA CompTox DTXSID1021039

Structure

InChI Key RCFKQVLHWYOSFF-UHFFFAOYSA-N
Smiles O=NN1CCCCCCC1
InChI
InChI=1S/C7H14N2O/c10-8-9-6-4-2-1-3-5-7-9/h1-7H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C7H14N2O1
Molecular Weight 142.11
AlogP 1.93
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 32.67
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 20917-49-1
NORMAN SUSDAT
FDA SRS 0VCF90A5FP