Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID301001254

Structure

InChI Key CAAWLEUNKIZZLS-UHFFFAOYSA-N
Smiles O=CN(CCCN(C)C)CCCN(C)C
InChI
InChI=1/C11H25N3O/c1-12(2)7-5-9-14(11-15)10-6-8-13(3)4/h11H,5-10H2,1-4H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H25N3O
Molecular Weight 215.2
AlogP 0.35
Hydrogen Bond Acceptor 3.0
Number of Rotational Bond 9.0
Polar Surface Area 26.79
Heavy Atoms 15.0

Cross References

Resources Reference
CAS NUMBER 80459-59-2
NORMAN SUSDAT
PubChem 3018940