3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide

C15H17FN2O2 — CID 110406226

IUPAC3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide
SMILESCCCNC(=O)CCc1cc2ccc(F)cc2[nH]c1=O
InChIInChI=1S/C15H17FN2O2/c1-2-7-17-14(19)6-4-11-8-10-3-5-12(16)9-13(10)18-15(11)20/h3,5,8-9H,2,4,6-7H2,1H3,(H,17,19)(H,18,20)
InChIKeyKKVWMWQIQPWJPF-UHFFFAOYSA-N
MW276.31 g/mol
LogP2.13
Rot. Bonds5

About 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide

3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide (PubChem CID 110406226) has the molecular formula C15H17FN2O2 and a molecular weight of 276.31 g/mol. Its IUPAC name is 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide.

Molecular Properties

Compound Name3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide
PubChem CID110406226
Molecular FormulaC15H17FN2O2
Molecular Weight276.31 g/mol
Exact Mass276.13
IUPAC Name3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide
SMILESCCCNC(=O)CCc1cc2ccc(F)cc2[nH]c1=O
InChIInChI=1S/C15H17FN2O2/c1-2-7-17-14(19)6-4-11-8-10-3-5-12(16)9-13(10)18-15(11)20/h3,5,8-9H,2,4,6-7H2,1H3,(H,17,19)(H,18,20)
InChIKeyKKVWMWQIQPWJPF-UHFFFAOYSA-N
XLogP2.13
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-butan-2-yl-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110406868
N-(4-acetamidophenyl)-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110423904
3-(7-methyl-2-oxo-1H-quinolin-3-yl)-N-pentylpropanamide
CID 110331188
2-(7-fluoro-2-oxo-1H-quinolin-3-yl)ethylcarbamic acid
CID 118936154
3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 110331644
N-(2,6-dimethylphenyl)-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110418371
N-[(3,4-dimethoxyphenyl)methyl]-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110412926
3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-(4-methoxyphenyl)propanamide
CID 110422053
N-(5-chloro-2-methylphenyl)-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110420828
N-cyclopentyl-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110407034
3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-pentylpropanamide
CID 110298877
ethyl 4-[3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanoylamino]benzoate
CID 110426665

Frequently Asked Questions

What is the IUPAC name of 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide?
The IUPAC name of 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide (CID 110406226) is 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide.
What is the SMILES notation for 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide?
The canonical SMILES for 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide is CCCNC(=O)CCc1cc2ccc(F)cc2[nH]c1=O.
What is the InChIKey of 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide?
The InChIKey is KKVWMWQIQPWJPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O2/c1-2-7-17-14(19)6-4-11-8-10-3-5-12(16)9-13(10)18-15(11)20/h3,5,8-9H,2,4,6-7H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide?
3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide has a molecular weight of 276.31 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-fluoro-2-oxo-1H-quinolin-3-yl)-N-propylpropanamide is sourced from PubChem (CID 110406226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).