2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide

C17H16FN3O2 — CID 126421605

IUPAC2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide
SMILESCc1ccc(NC(=O)CN2C(=O)CCc3cccc(F)c32)nc1
InChIInChI=1S/C17H16FN3O2/c1-11-5-7-14(19-9-11)20-15(22)10-21-16(23)8-6-12-3-2-4-13(18)17(12)21/h2-5,7,9H,6,8,10H2,1H3,(H,19,20,22)
InChIKeyYBVXALSDJDNJKD-UHFFFAOYSA-N
MW313.33 g/mol
LogP2.45
Rot. Bonds3

About 2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide

2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide (PubChem CID 126421605) has the molecular formula C17H16FN3O2 and a molecular weight of 313.33 g/mol. Its IUPAC name is 2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide
PubChem CID126421605
Molecular FormulaC17H16FN3O2
Molecular Weight313.33 g/mol
Exact Mass313.12
IUPAC Name2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide
SMILESCc1ccc(NC(=O)CN2C(=O)CCc3cccc(F)c32)nc1
InChIInChI=1S/C17H16FN3O2/c1-11-5-7-14(19-9-11)20-15(22)10-21-16(23)8-6-12-3-2-4-13(18)17(12)21/h2-5,7,9H,6,8,10H2,1H3,(H,19,20,22)
InChIKeyYBVXALSDJDNJKD-UHFFFAOYSA-N
XLogP2.45
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.33
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide
CID 126420480
2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 171133276
N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide
CID 171132612
1-[[(5-methyl-2-pyridinyl)amino]methyl]pyrrolidine-2,5-dione
CID 1237548
2-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-(5-methyl-2-pyridinyl)acetamide
CID 98385049
N-(5-methyl-2-pyridinyl)-2-(3-oxo-1,4-benzothiazin-4-yl)acetamide
CID 18106820
4-(2-fluorophenoxy)-N-(5-methyl-2-pyridinyl)butanamide
CID 52714969
N-(5-methyl-2-pyridinyl)-2-sulfanylacetamide
CID 83773687
N-(3-methylsulfanylphenyl)-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide
CID 22548644
1-(3-fluoro-2-pyridinyl)-3-(5-methyl-2-pyridinyl)urea
CID 18682339
2-benzhydrylsulfanyl-N-(5-methyl-2-pyridinyl)acetamide
CID 46651551
2-(3-aminophenyl)-N-(5-methyl-2-pyridinyl)acetamide
CID 62500128

Frequently Asked Questions

What is the IUPAC name of 2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide (CID 126421605) is 2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide is Cc1ccc(NC(=O)CN2C(=O)CCc3cccc(F)c32)nc1.
What is the InChIKey of 2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide?
The InChIKey is YBVXALSDJDNJKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3O2/c1-11-5-7-14(19-9-11)20-15(22)10-21-16(23)8-6-12-3-2-4-13(18)17(12)21/h2-5,7,9H,6,8,10H2,1H3,(H,19,20,22).
What are the key properties of 2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide?
2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide has a molecular weight of 313.33 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 126421605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).