N-(4-acetylphenyl)ethanesulfonamide

C10H13NO3S — CID 1219330

IUPACN-(4-acetylphenyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C10H13NO3S/c1-3-15(13,14)11-10-6-4-9(5-7-10)8(2)12/h4-7,11H,3H2,1-2H3
InChIKeyCKEWVNFPYIPXBG-UHFFFAOYSA-N
MW227.28 g/mol
LogP1.65
Rot. Bonds4

About N-(4-acetylphenyl)ethanesulfonamide

N-(4-acetylphenyl)ethanesulfonamide (PubChem CID 1219330) has the molecular formula C10H13NO3S and a molecular weight of 227.28 g/mol. Its IUPAC name is N-(4-acetylphenyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)ethanesulfonamide
PubChem CID1219330
Molecular FormulaC10H13NO3S
Molecular Weight227.28 g/mol
Exact Mass227.06
IUPAC NameN-(4-acetylphenyl)ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(C(C)=O)cc1
InChIInChI=1S/C10H13NO3S/c1-3-15(13,14)11-10-6-4-9(5-7-10)8(2)12/h4-7,11H,3H2,1-2H3
InChIKeyCKEWVNFPYIPXBG-UHFFFAOYSA-N
XLogP1.65
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.28
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-ethylbutanoyl)phenyl]ethanesulfonamide
CID 43161166
1-[4-[(4-acetylphenyl)sulfamoylsulfamoylamino]phenyl]ethanone
CID 12781230
4-(ethylsulfonylamino)benzenecarbothioamide
CID 24696000
ethyl 2-[4-(ethylsulfonylamino)phenyl]-2-oxoacetate
CID 55017437
N-(4-acetylphenyl)-1-(2-chlorophenyl)methanesulfonamide
CID 3991135
4-bromo-N-[4-(ethylsulfonylamino)phenyl]benzamide
CID 47051930
N-(4-chlorophenyl)-4-(ethylsulfonylamino)benzamide
CID 92643113
N-[4-(piperidine-1-carbonyl)phenyl]ethanesulfonamide
CID 2995976
N-[4-(2,2-dimethylcyclopropanecarbonyl)phenyl]ethanesulfonamide
CID 107000679
N-[4-[4-(ethylsulfonylamino)phenoxy]phenyl]ethanesulfonamide
CID 1292287
N-(4-ethylphenyl)ethanesulfonamide
CID 896511
N-[4-(3,4,4-trimethylpentanoyl)phenyl]ethanesulfonamide
CID 63834820

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)ethanesulfonamide?
The IUPAC name of N-(4-acetylphenyl)ethanesulfonamide (CID 1219330) is N-(4-acetylphenyl)ethanesulfonamide.
What is the SMILES notation for N-(4-acetylphenyl)ethanesulfonamide?
The canonical SMILES for N-(4-acetylphenyl)ethanesulfonamide is CCS(=O)(=O)Nc1ccc(C(C)=O)cc1.
What is the InChIKey of N-(4-acetylphenyl)ethanesulfonamide?
The InChIKey is CKEWVNFPYIPXBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3S/c1-3-15(13,14)11-10-6-4-9(5-7-10)8(2)12/h4-7,11H,3H2,1-2H3.
What are the key properties of N-(4-acetylphenyl)ethanesulfonamide?
N-(4-acetylphenyl)ethanesulfonamide has a molecular weight of 227.28 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)ethanesulfonamide is sourced from PubChem (CID 1219330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).