2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide

C19H18N2O4S — CID 99978025

IUPAC2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CS(=O)(=O)c2ccc3[nH]c(=O)cc(C)c3c2)c1
InChIInChI=1S/C19H18N2O4S/c1-12-4-3-5-14(8-12)20-19(23)11-26(24,25)15-6-7-17-16(10-15)13(2)9-18(22)21-17/h3-10H,11H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyNMRRFTGATXSUON-UHFFFAOYSA-N
MW370.43 g/mol
LogP2.56
Rot. Bonds4

About 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide

2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide (PubChem CID 99978025) has the molecular formula C19H18N2O4S and a molecular weight of 370.43 g/mol. Its IUPAC name is 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide
PubChem CID99978025
Molecular FormulaC19H18N2O4S
Molecular Weight370.43 g/mol
Exact Mass370.10
IUPAC Name2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)CS(=O)(=O)c2ccc3[nH]c(=O)cc(C)c3c2)c1
InChIInChI=1S/C19H18N2O4S/c1-12-4-3-5-14(8-12)20-19(23)11-26(24,25)15-6-7-17-16(10-15)13(2)9-18(22)21-17/h3-10H,11H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyNMRRFTGATXSUON-UHFFFAOYSA-N
XLogP2.56
TPSA96.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,4-dimethylphenyl)sulfonyl-N-(3-methylphenyl)acetamide
CID 86992898
6-[(3-methylphenyl)sulfamoyl]-2-oxo-1H-quinoline-4-carboxylic acid
CID 2396440
4-methyl-2-oxo-N-phenyl-1H-quinoline-6-sulfonamide
CID 16804856
N-(3-methylphenyl)-2-prop-2-ynylsulfonylacetamide
CID 82368875
4,8-dimethyl-N-(3-methylphenyl)-2-oxo-1H-quinoline-6-sulfonamide
CID 16824699
2-(4-methylphenyl)sulfonyl-N-[3-(trifluoromethyl)phenyl]acetamide
CID 3686927
2-(4-methylphenyl)sulfonyl-N-(3-nitrophenyl)acetamide
CID 7543832
N-(3-methylphenyl)-2-oxo-1H-quinoline-5-carboxamide
CID 166776296
N-(3-acetylphenyl)-2-(4-fluorophenyl)sulfonylacetamide
CID 7544853
N-(2-aminoethyl)-2-[2-(3-methylanilino)-2-oxoethyl]sulfonylacetamide
CID 39162194
2-(1-methylimidazol-2-yl)sulfonyl-N-(3-methylphenyl)acetamide
CID 23858228
N-[[3-[(3-methylphenyl)carbamoylamino]phenyl]methyl]-6-morpholin-4-ylsulfonyl-2-oxo-1H-quinoline-4-carboxamide
CID 167769192

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide (CID 99978025) is 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide is Cc1cccc(NC(=O)CS(=O)(=O)c2ccc3[nH]c(=O)cc(C)c3c2)c1.
What is the InChIKey of 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide?
The InChIKey is NMRRFTGATXSUON-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4S/c1-12-4-3-5-14(8-12)20-19(23)11-26(24,25)15-6-7-17-16(10-15)13(2)9-18(22)21-17/h3-10H,11H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide?
2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide has a molecular weight of 370.43 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methyl-2-oxo-1H-quinolin-6-yl)sulfonyl]-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 99978025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).