N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide

C18H17FN2O2 — CID 171132612

IUPACN-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide
SMILESO=C(CN1C(=O)CCc2cccc(F)c21)NCc1ccccc1
InChIInChI=1S/C18H17FN2O2/c19-15-8-4-7-14-9-10-17(23)21(18(14)15)12-16(22)20-11-13-5-2-1-3-6-13/h1-8H,9-12H2,(H,20,22)
InChIKeyGLQBJLUSARLBGA-UHFFFAOYSA-N
MW312.34 g/mol
LogP2.42
Rot. Bonds4

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

N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide (PubChem CID 171132612) has the molecular formula C18H17FN2O2 and a molecular weight of 312.34 g/mol. Its IUPAC name is N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide
PubChem CID171132612
Molecular FormulaC18H17FN2O2
Molecular Weight312.34 g/mol
Exact Mass312.13
IUPAC NameN-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide
SMILESO=C(CN1C(=O)CCc2cccc(F)c21)NCc1ccccc1
InChIInChI=1S/C18H17FN2O2/c19-15-8-4-7-14-9-10-17(23)21(18(14)15)12-16(22)20-11-13-5-2-1-3-6-13/h1-8H,9-12H2,(H,20,22)
InChIKeyGLQBJLUSARLBGA-UHFFFAOYSA-N
XLogP2.42
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.34
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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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
2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)-N-(5-methyl-2-pyridinyl)acetamide
CID 126421605
1-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-8-fluoro-3,4-dihydroquinolin-2-one
CID 171132610
N-benzyl-2-(2-oxo-6-pyrrolidin-1-ylsulfonyl-3,4-dihydroquinolin-1-yl)acetamide
CID 20958718
N-[(4-methylsulfanylphenyl)methyl]-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetamide
CID 46276082
N-[(4-methylphenyl)methyl]-2-(2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetamide
CID 46276056
3-[[[2-(2,5-dioxoimidazolidin-1-yl)acetyl]amino]methyl]benzoic acid
CID 60895323
N-[2-(4-fluorophenyl)-2-hydroxyethyl]-2-(2-oxo-3,4-dihydroquinolin-1-yl)acetamide
CID 111115296
2-(2,5-dioxopyrrolidin-1-yl)-N-(2-hydroxy-3-phenylpropyl)acetamide
CID 90534330
2-(2,5-dioxopyrrolidin-1-yl)-N-(2-hydroxy-2-naphthalen-1-ylethyl)acetamide
CID 56764107
N-benzyl-2-[4-(3-methylphenyl)-2,6-dioxo-1,3-diazinan-1-yl]acetamide
CID 46044295

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
The IUPAC name of N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide (CID 171132612) is N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide.
What is the SMILES notation for N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
The canonical SMILES for N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide is O=C(CN1C(=O)CCc2cccc(F)c21)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
The InChIKey is GLQBJLUSARLBGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O2/c19-15-8-4-7-14-9-10-17(23)21(18(14)15)12-16(22)20-11-13-5-2-1-3-6-13/h1-8H,9-12H2,(H,20,22).
What are the key properties of N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide?
N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide has a molecular weight of 312.34 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(8-fluoro-2-oxo-3,4-dihydroquinolin-1-yl)acetamide is sourced from PubChem (CID 171132612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).