Structure

InChI Key WYWZRNAHINYAEF-UHFFFAOYSA-N
Smile CCCCC(CC)COC(=O)c1ccc(N(C)C)cc1
InChI
InChI=1S/C17H27NO2/c1-5-7-8-14(6-2)13-20-17(19)15-9-11-16(12-10-15)18(3)4/h9-12,14H,5-8,13H2,1-4H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H27NO2
Molecular Weight 277.41
AlogP 4.13
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 8.0
Polar Surface Area 29.54
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 20.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Cross References

Resources Reference
ChEBI 135932
ChEMBL CHEMBL1323699
DrugBank DB11570
DrugCentral 4270
EPA CompTox DTXSID7029320
FDA SRS Z11006CMUZ
PubChem 30541
SureChEMBL SCHEMBL15432