Keyword(s): Human Metabolites
Molecule Category Free-form
UNII BR551134L6

Structure

InChI Key LUKOGYUKYPZBFP-UHFFFAOYSA-N
Smiles Fc1ccc(cc1)C(=O)CCCN2CCCCC2
InChI
InChI=1/C15H20FNO/c16-14-8-6-13(7-9-14)15(18)5-4-12-17-10-2-1-3-11-17/h6-9H,1-5,10-12H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H20FNO
Molecular Weight 249.15
AlogP 3.27
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 20.31
Heavy Atoms 18.0

Cross References

Resources Reference
CAS NUMBER 1219-35-8
NORMAN SUSDAT
FDA SRS BR551134L6