4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one

C17H20FNO2 — CID 503382

IUPAC4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one
SMILESCCCc1c(OCC2CCC2)c2cc(F)ccc2[nH]c1=O
InChIInChI=1S/C17H20FNO2/c1-2-4-13-16(21-10-11-5-3-6-11)14-9-12(18)7-8-15(14)19-17(13)20/h7-9,11H,2-6,10H2,1H3,(H,19,20)
InChIKeyGNIVMZRBPBRPOZ-UHFFFAOYSA-N
MW289.35 g/mol
LogP3.80
Rot. Bonds5

About 4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one

4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one (PubChem CID 503382) has the molecular formula C17H20FNO2 and a molecular weight of 289.35 g/mol. Its IUPAC name is 4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one.

Molecular Properties

Compound Name4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one
PubChem CID503382
Molecular FormulaC17H20FNO2
Molecular Weight289.35 g/mol
Exact Mass289.15
IUPAC Name4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one
SMILESCCCc1c(OCC2CCC2)c2cc(F)ccc2[nH]c1=O
InChIInChI=1S/C17H20FNO2/c1-2-4-13-16(21-10-11-5-3-6-11)14-9-12(18)7-8-15(14)19-17(13)20/h7-9,11H,2-6,10H2,1H3,(H,19,20)
InChIKeyGNIVMZRBPBRPOZ-UHFFFAOYSA-N
XLogP3.80
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.35
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one?
The IUPAC name of 4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one (CID 503382) is 4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one.
What is the SMILES notation for 4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one?
The canonical SMILES for 4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one is CCCc1c(OCC2CCC2)c2cc(F)ccc2[nH]c1=O.
What is the InChIKey of 4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one?
The InChIKey is GNIVMZRBPBRPOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FNO2/c1-2-4-13-16(21-10-11-5-3-6-11)14-9-12(18)7-8-15(14)19-17(13)20/h7-9,11H,2-6,10H2,1H3,(H,19,20).
What are the key properties of 4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one?
4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one has a molecular weight of 289.35 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclobutylmethoxy)-6-fluoro-3-propyl-1H-quinolin-2-one is sourced from PubChem (CID 503382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).