N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide

C17H16N2O3S — CID 935269

IUPACN-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
SMILESCN(Cc1cc2ccccc2[nH]c1=O)S(=O)(=O)c1ccccc1
InChIInChI=1S/C17H16N2O3S/c1-19(23(21,22)15-8-3-2-4-9-15)12-14-11-13-7-5-6-10-16(13)18-17(14)20/h2-11H,12H2,1H3,(H,18,20)
InChIKeyUVWPNPVGZYVQCR-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.35
Rot. Bonds4

About N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide

N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide (PubChem CID 935269) has the molecular formula C17H16N2O3S and a molecular weight of 328.39 g/mol. Its IUPAC name is N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide.

Molecular Properties

Compound NameN-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
PubChem CID935269
Molecular FormulaC17H16N2O3S
Molecular Weight328.39 g/mol
Exact Mass328.09
IUPAC NameN-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
SMILESCN(Cc1cc2ccccc2[nH]c1=O)S(=O)(=O)c1ccccc1
InChIInChI=1S/C17H16N2O3S/c1-19(23(21,22)15-8-3-2-4-9-15)12-14-11-13-7-5-6-10-16(13)18-17(14)20/h2-11H,12H2,1H3,(H,18,20)
InChIKeyUVWPNPVGZYVQCR-UHFFFAOYSA-N
XLogP2.35
TPSA70.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[methyl-[(2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]phenyl]acetamide
CID 4902121
N-ethyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]methanesulfonamide
CID 3159257
N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 942796
N-[(2-oxo-1H-quinolin-3-yl)methyl]-N-propan-2-ylacetamide
CID 945365
N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-propan-2-ylbenzenesulfonamide
CID 4972680
N-(2-methylpropyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]methanesulfonamide
CID 4903915
N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylpropyl)benzenesulfonamide
CID 4903834
N-butyl-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 2028486
N-[(4-fluorophenyl)methyl]-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 1161628
N-benzyl-4-methyl-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 1149817
N-(3,4-dimethylphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 23605192
N-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)benzenesulfonamide
CID 1165503

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide?
The IUPAC name of N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide (CID 935269) is N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide.
What is the SMILES notation for N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide?
The canonical SMILES for N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide is CN(Cc1cc2ccccc2[nH]c1=O)S(=O)(=O)c1ccccc1.
What is the InChIKey of N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide?
The InChIKey is UVWPNPVGZYVQCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3S/c1-19(23(21,22)15-8-3-2-4-9-15)12-14-11-13-7-5-6-10-16(13)18-17(14)20/h2-11H,12H2,1H3,(H,18,20).
What are the key properties of N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide?
N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide has a molecular weight of 328.39 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide is sourced from PubChem (CID 935269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).