N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide

C18H22N2O3S — CID 94622687

IUPACN-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide
SMILESCCN(c1cc(C)ccc1C)S(=O)(=O)c1ccc(NC(C)=O)cc1
InChIInChI=1S/C18H22N2O3S/c1-5-20(18-12-13(2)6-7-14(18)3)24(22,23)17-10-8-16(9-11-17)19-15(4)21/h6-12H,5H2,1-4H3,(H,19,21)
InChIKeyFCLSRSGQJWTRRC-UHFFFAOYSA-N
MW346.45 g/mol
LogP3.48
Rot. Bonds5

About N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide

N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide (PubChem CID 94622687) has the molecular formula C18H22N2O3S and a molecular weight of 346.45 g/mol. Its IUPAC name is N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide
PubChem CID94622687
Molecular FormulaC18H22N2O3S
Molecular Weight346.45 g/mol
Exact Mass346.14
IUPAC NameN-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide
SMILESCCN(c1cc(C)ccc1C)S(=O)(=O)c1ccc(NC(C)=O)cc1
InChIInChI=1S/C18H22N2O3S/c1-5-20(18-12-13(2)6-7-14(18)3)24(22,23)17-10-8-16(9-11-17)19-15(4)21/h6-12H,5H2,1-4H3,(H,19,21)
InChIKeyFCLSRSGQJWTRRC-UHFFFAOYSA-N
XLogP3.48
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.45
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(diethylsulfamoyl)phenyl]-2-(2,5-dimethyl-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 126254789
2-[(4-acetamidophenyl)sulfonyl-methylamino]-N-(2,5-dimethylphenyl)-N-methylacetamide
CID 55917959
N-(4-acetamidophenyl)-2-(2,5-dimethyl-N-methylsulfonylanilino)acetamide
CID 113153893
N-[4-(diethylsulfamoyl)phenyl]-4-(2,5-dimethyl-N-methylsulfonylanilino)butanamide
CID 21368260
2-[N-(benzenesulfonyl)-2,5-dimethylanilino]-N-(4-phenylphenyl)acetamide
CID 30173912
N-(2,5-dimethylphenyl)-N-ethylnaphthalene-2-sulfonamide
CID 100530394
2-(2,5-dimethyl-N-(4-methylphenyl)sulfonylanilino)-N-methylacetamide
CID 846688
2-(2,5-dimethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methylphenyl)acetamide
CID 30170588
2-(2,5-dimethyl-N-(4-methylphenyl)sulfonylanilino)-N,N-dimethylacetamide
CID 1095213
N-[(2S)-butan-2-yl]-2-(2,5-dimethyl-N-(4-methylphenyl)sulfonylanilino)acetamide
CID 2272420
N-[4-[(4-methylphenyl)-[(4-methylphenyl)methyl]sulfamoyl]phenyl]acetamide
CID 46022239
methyl 2-(N-(4-acetamidophenyl)sulfonyl-2,4,6-trimethylanilino)acetate
CID 50889481

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide (CID 94622687) is N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide is CCN(c1cc(C)ccc1C)S(=O)(=O)c1ccc(NC(C)=O)cc1.
What is the InChIKey of N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide?
The InChIKey is FCLSRSGQJWTRRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S/c1-5-20(18-12-13(2)6-7-14(18)3)24(22,23)17-10-8-16(9-11-17)19-15(4)21/h6-12H,5H2,1-4H3,(H,19,21).
What are the key properties of N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide?
N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide has a molecular weight of 346.45 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2,5-dimethylphenyl)-ethylsulfamoyl]phenyl]acetamide is sourced from PubChem (CID 94622687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).