2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide

C21H15FN2O2 — CID 100743004

IUPAC2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide
SMILESO=C(Cn1ccc(=O)c2cc(F)ccc21)Nc1cccc2ccccc12
InChIInChI=1S/C21H15FN2O2/c22-15-8-9-19-17(12-15)20(25)10-11-24(19)13-21(26)23-18-7-3-5-14-4-1-2-6-16(14)18/h1-12H,13H2,(H,23,26)
InChIKeyZPCUTNJZWQBKLT-UHFFFAOYSA-N
MW346.36 g/mol
LogP3.93
Rot. Bonds3

About 2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide

2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide (PubChem CID 100743004) has the molecular formula C21H15FN2O2 and a molecular weight of 346.36 g/mol. Its IUPAC name is 2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide.

Molecular Properties

Compound Name2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide
PubChem CID100743004
Molecular FormulaC21H15FN2O2
Molecular Weight346.36 g/mol
Exact Mass346.11
IUPAC Name2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide
SMILESO=C(Cn1ccc(=O)c2cc(F)ccc21)Nc1cccc2ccccc12
InChIInChI=1S/C21H15FN2O2/c22-15-8-9-19-17(12-15)20(25)10-11-24(19)13-21(26)23-18-7-3-5-14-4-1-2-6-16(14)18/h1-12H,13H2,(H,23,26)
InChIKeyZPCUTNJZWQBKLT-UHFFFAOYSA-N
XLogP3.93
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.36
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(6-fluoro-4-oxoquinolin-1-yl)-N-[(1R)-1-phenylethyl]acetamide
CID 100742748
N-(3-chloro-2-fluorophenyl)-2-(4-oxoquinolin-1-yl)acetamide
CID 47780650
N-(2-hydroxyphenyl)-2-(4-oxoquinolin-1-yl)acetamide
CID 47840872
N-(5-chloro-2-methoxyphenyl)-2-(6-fluoro-4-oxoquinolin-1-yl)acetamide
CID 100743429
N-(2-chloro-4-fluorophenyl)-2-(1-oxoisoquinolin-2-yl)acetamide
CID 9354365
2-(6-fluoro-4-oxoquinolin-1-yl)-N-(2-methylpropyl)acetamide
CID 100742567
N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741423
N-(3-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 43832718
N-(2-amino-5-fluorophenyl)-2-indol-1-ylacetamide
CID 43611958
2-(6-chloro-4-oxoquinolin-1-yl)-N-(2,4-dichlorophenyl)acetamide
CID 100735074
2-[4-(2-chloro-4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-naphthalen-1-ylacetamide
CID 56518590
N-(2-ethylphenyl)-2-(8-fluoro-4-oxoquinolin-1-yl)acetamide
CID 43832820

Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide?
The IUPAC name of 2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide (CID 100743004) is 2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide.
What is the SMILES notation for 2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide?
The canonical SMILES for 2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide is O=C(Cn1ccc(=O)c2cc(F)ccc21)Nc1cccc2ccccc12.
What is the InChIKey of 2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide?
The InChIKey is ZPCUTNJZWQBKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15FN2O2/c22-15-8-9-19-17(12-15)20(25)10-11-24(19)13-21(26)23-18-7-3-5-14-4-1-2-6-16(14)18/h1-12H,13H2,(H,23,26).
What are the key properties of 2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide?
2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide has a molecular weight of 346.36 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoro-4-oxoquinolin-1-yl)-N-naphthalen-1-ylacetamide is sourced from PubChem (CID 100743004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).