Keyword(s): Human Metabolites
Molecule Category Free-form
UNII YV6HBY8RL9
EPA CompTox DTXSID20184831

Structure

InChI Key SZYLDXKMZNIHDQ-UHFFFAOYSA-N
Smiles CN(C)CCN(C)CCN(C)CCN(C)CCN(C)C
InChI
InChI=1S/C15H37N5/c1-16(2)8-10-18(5)12-14-20(7)15-13-19(6)11-9-17(3)4/h8-15H2,1-7H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H37N5
Molecular Weight 287.3
AlogP -0.09
Hydrogen Bond Acceptor 5.0
Number of Rotational Bond 12.0
Polar Surface Area 16.2
Heavy Atoms 20.0

Cross References

Resources Reference
CAS NUMBER 3083-11-2
NORMAN SUSDAT
FDA SRS YV6HBY8RL9
PubChem 76510
ChemSpider 68980.0