N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide

C15H15NO3S — CID 13293562

IUPACN-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide
SMILESCC(NS(=O)(=O)c1ccccc1)C(=O)c1ccccc1
InChIInChI=1S/C15H15NO3S/c1-12(15(17)13-8-4-2-5-9-13)16-20(18,19)14-10-6-3-7-11-14/h2-12,16H,1H3
InChIKeyJHAUWGKFHRBVNF-UHFFFAOYSA-N
MW289.36 g/mol
LogP2.24
Rot. Bonds5

About N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide

N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide (PubChem CID 13293562) has the molecular formula C15H15NO3S and a molecular weight of 289.36 g/mol. Its IUPAC name is N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide
PubChem CID13293562
Molecular FormulaC15H15NO3S
Molecular Weight289.36 g/mol
Exact Mass289.08
IUPAC NameN-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide
SMILESCC(NS(=O)(=O)c1ccccc1)C(=O)c1ccccc1
InChIInChI=1S/C15H15NO3S/c1-12(15(17)13-8-4-2-5-9-13)16-20(18,19)14-10-6-3-7-11-14/h2-12,16H,1H3
InChIKeyJHAUWGKFHRBVNF-UHFFFAOYSA-N
XLogP2.24
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.36
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-oxobutan-2-yl)benzenesulfonamide
CID 64994182
(2R)-2-(benzenesulfonamido)propanamide
CID 970705
methyl (2S)-2-(benzenesulfonamido)propanoate
CID 10857687
(2S)-2-(benzenesulfonamido)-N-phenylpropanamide
CID 41330853
2-(benzenesulfonamido)-N-propan-2-ylpropanamide
CID 3279426
N-(4-acetamidophenyl)-2-(benzenesulfonamido)propanamide
CID 4240198
(2S)-2-(benzenesulfonamido)-N-benzhydrylpropanamide
CID 124596255
[1-(benzenesulfonamido)-3-oxo-1,3-diphenylpropan-2-yl]-dimethylsulfanium
CID 10788532
(2S)-2-(benzenesulfonamido)-3-methylbutanoic acid;methane
CID 158887122
(2R)-2-[(3-acetylphenyl)sulfonylamino]propanoic acid
CID 29049479
(2S)-2-(benzenesulfonamido)-N-[(2R)-butan-2-yl]propanamide
CID 41330742
(2S)-2-(benzenesulfonamido)-N-(2-phenylethyl)propanamide
CID 41330945

Frequently Asked Questions

What is the IUPAC name of N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide?
The IUPAC name of N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide (CID 13293562) is N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide.
What is the SMILES notation for N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide?
The canonical SMILES for N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide is CC(NS(=O)(=O)c1ccccc1)C(=O)c1ccccc1.
What is the InChIKey of N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide?
The InChIKey is JHAUWGKFHRBVNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3S/c1-12(15(17)13-8-4-2-5-9-13)16-20(18,19)14-10-6-3-7-11-14/h2-12,16H,1H3.
What are the key properties of N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide?
N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide has a molecular weight of 289.36 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide is sourced from PubChem (CID 13293562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).