4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one

C16H12FNOS — CID 24895893

IUPAC4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one
SMILESCn1c(=O)cc(Sc2ccccc2F)c2ccccc21
InChIInChI=1S/C16H12FNOS/c1-18-13-8-4-2-6-11(13)15(10-16(18)19)20-14-9-5-3-7-12(14)17/h2-10H,1H3
InChIKeyMVKYDDGUNLTKKG-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.83
Rot. Bonds2

About 4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one

4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one (PubChem CID 24895893) has the molecular formula C16H12FNOS and a molecular weight of 285.34 g/mol. Its IUPAC name is 4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one.

Molecular Properties

Compound Name4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one
PubChem CID24895893
Molecular FormulaC16H12FNOS
Molecular Weight285.34 g/mol
Exact Mass285.06
IUPAC Name4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one
SMILESCn1c(=O)cc(Sc2ccccc2F)c2ccccc21
InChIInChI=1S/C16H12FNOS/c1-18-13-8-4-2-6-11(13)15(10-16(18)19)20-14-9-5-3-7-12(14)17/h2-10H,1H3
InChIKeyMVKYDDGUNLTKKG-UHFFFAOYSA-N
XLogP3.83
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-Methyl-4-[(4-methylphenyl)thio]-3-nitro-2-quinolinone
CID 776319
1-(2,3-Dihydroindol-1-yl)-2-(phenylthio)ethanone
CID 736577
4-(2-fluorobenzyl)-2H-benzo[b][1,4]thiazin-3(4H)-one
CID 3244415
1-Benzyl-4-methyl-1H-quinolin-2-one
CID 1480959
1-methyl-4-phenylquinolin-2(1H)-one
CID 684365
1-ethyl-4-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]thio}quinolin-2(1H)-one
CID 3236585
1-ethyl-4-[(2-oxo-2-piperidin-1-ylethyl)thio]quinolin-2(1H)-one
CID 3240943
1-(2-Methyl-2,3-dihydroindol-1-yl)-2-phenylsulfanylethanone
CID 3435469
N-Benzyl-2-[(1-ethyl-2-oxo-1,2-dihydroquinolin-4-YL)sulfanyl]-N-methylacetamide
CID 6622576
1-methyl-4-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}quinolin-2(1H)-one
CID 9550973
2-[(1-Ethyl-2-oxo-1,2-dihydroquinolin-4-YL)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide
CID 9551251
1-Ethyl-4-({2-[4-(2-fluorophenyl)piperazin-1-YL]-2-oxoethyl}sulfanyl)-1,2-dihydroquinolin-2-one
CID 9551253

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one?
The IUPAC name of 4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one (CID 24895893) is 4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one.
What is the SMILES notation for 4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one?
The canonical SMILES for 4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one is Cn1c(=O)cc(Sc2ccccc2F)c2ccccc21.
What is the InChIKey of 4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one?
The InChIKey is MVKYDDGUNLTKKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNOS/c1-18-13-8-4-2-6-11(13)15(10-16(18)19)20-14-9-5-3-7-12(14)17/h2-10H,1H3.
What are the key properties of 4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one?
4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one has a molecular weight of 285.34 g/mol, XLogP of 3.83, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)sulfanyl-1-methylquinolin-2-one is sourced from PubChem (CID 24895893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).