N-benzyl-2-oxo-2-phenylethanesulfonamide

C15H15NO3S — CID 10424265

IUPACN-benzyl-2-oxo-2-phenylethanesulfonamide
SMILESO=C(CS(=O)(=O)NCc1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO3S/c17-15(14-9-5-2-6-10-14)12-20(18,19)16-11-13-7-3-1-4-8-13/h1-10,16H,11-12H2
InChIKeyALAQSDTZDTYXFI-UHFFFAOYSA-N
MW289.36 g/mol
LogP1.99
Rot. Bonds6

About N-benzyl-2-oxo-2-phenylethanesulfonamide

N-benzyl-2-oxo-2-phenylethanesulfonamide (PubChem CID 10424265) has the molecular formula C15H15NO3S and a molecular weight of 289.36 g/mol. Its IUPAC name is N-benzyl-2-oxo-2-phenylethanesulfonamide.

Molecular Properties

Compound NameN-benzyl-2-oxo-2-phenylethanesulfonamide
PubChem CID10424265
Molecular FormulaC15H15NO3S
Molecular Weight289.36 g/mol
Exact Mass289.08
IUPAC NameN-benzyl-2-oxo-2-phenylethanesulfonamide
SMILESO=C(CS(=O)(=O)NCc1ccccc1)c1ccccc1
InChIInChI=1S/C15H15NO3S/c17-15(14-9-5-2-6-10-14)12-20(18,19)16-11-13-7-3-1-4-8-13/h1-10,16H,11-12H2
InChIKeyALAQSDTZDTYXFI-UHFFFAOYSA-N
XLogP1.99
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.36
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(phenylsulfonyl)benzamide
CID 229604
H2S Donor 5a
CID 14952493
N-(2-oxo-2-phenylethyl)methanesulfonamide
CID 21893541
N-[2-(benzylsulfamoyl)ethyl]benzamide
CID 7423250
N-(2-(N-phenethylsulfamoyl)ethyl)benzamide
CID 7423263
N-(2-(N-(3-phenylpropyl)sulfamoyl)ethyl)benzamide
CID 18582824
2-(3-Benzoyl-5-diethylaminomethyl-phenyl)-ethenesulfonic acid amide
CID 44366915
N-(methylsulfonyl)benzamide
CID 1547994
(4-(Aminomethyl)phenyl)(phenyl)methanone
CID 2760963
S-benzamido 2-phenylethanethioate
CID 88533970
(Z)-4-amino-1,3-diphenylbut-2-en-1-one
CID 141444019
4-methyl-N-(2-oxo-2-phenylethyl)benzenesulfonamide
CID 2306777

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-oxo-2-phenylethanesulfonamide?
The IUPAC name of N-benzyl-2-oxo-2-phenylethanesulfonamide (CID 10424265) is N-benzyl-2-oxo-2-phenylethanesulfonamide.
What is the SMILES notation for N-benzyl-2-oxo-2-phenylethanesulfonamide?
The canonical SMILES for N-benzyl-2-oxo-2-phenylethanesulfonamide is O=C(CS(=O)(=O)NCc1ccccc1)c1ccccc1.
What is the InChIKey of N-benzyl-2-oxo-2-phenylethanesulfonamide?
The InChIKey is ALAQSDTZDTYXFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3S/c17-15(14-9-5-2-6-10-14)12-20(18,19)16-11-13-7-3-1-4-8-13/h1-10,16H,11-12H2.
What are the key properties of N-benzyl-2-oxo-2-phenylethanesulfonamide?
N-benzyl-2-oxo-2-phenylethanesulfonamide has a molecular weight of 289.36 g/mol, XLogP of 1.99, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-oxo-2-phenylethanesulfonamide is sourced from PubChem (CID 10424265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).