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

Structure

InChI Key UXCABTUQGBBPPF-MNOVXSKESA-N
Smiles O[C@H]1CCCC[C@H]1N2CCCCC2
InChI
InChI=1/C11H21NO/c13-11-7-3-2-6-10(11)12-8-4-1-5-9-12/h10-11,13H,1-9H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H21NO
Molecular Weight 183.16
AlogP 1.78
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 23.47
Heavy Atoms 13.0

Cross References

Resources Reference
CAS NUMBER 7583-84-8
NORMAN SUSDAT