2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide

C17H19N3O4S — CID 18277249

IUPAC2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide
SMILESCC(=O)Nc1ccc(CC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1
InChIInChI=1S/C17H19N3O4S/c1-11-3-6-15(10-16(11)25(18,23)24)20-17(22)9-13-4-7-14(8-5-13)19-12(2)21/h3-8,10H,9H2,1-2H3,(H,19,21)(H,20,22)(H2,18,23,24)
InChIKeyDQNKWHRCFWSBIP-UHFFFAOYSA-N
MW361.42 g/mol
LogP1.78
Rot. Bonds5

About 2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide

2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide (PubChem CID 18277249) has the molecular formula C17H19N3O4S and a molecular weight of 361.42 g/mol. Its IUPAC name is 2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide
PubChem CID18277249
Molecular FormulaC17H19N3O4S
Molecular Weight361.42 g/mol
Exact Mass361.11
IUPAC Name2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide
SMILESCC(=O)Nc1ccc(CC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1
InChIInChI=1S/C17H19N3O4S/c1-11-3-6-15(10-16(11)25(18,23)24)20-17(22)9-13-4-7-14(8-5-13)19-12(2)21/h3-8,10H,9H2,1-2H3,(H,19,21)(H,20,22)(H2,18,23,24)
InChIKeyDQNKWHRCFWSBIP-UHFFFAOYSA-N
XLogP1.78
TPSA118.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.42
LogP ≤ 51.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-(4-sulfamoylphenyl)acetamide
CID 56511573
3-(4-ethylphenyl)-N-(4-methyl-3-sulfamoylphenyl)propanamide
CID 9141287
N-(4-methylphenyl)-2-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]sulfanylacetamide
CID 9141188
N-(4-methyl-3-sulfamoylphenyl)-2-thiophen-2-ylacetamide
CID 9140832
2-(1H-indol-3-yl)-N-(4-methyl-3-sulfamoylphenyl)acetamide
CID 9140853
3,3,3-trifluoro-N-(4-methyl-3-sulfamoylphenyl)propanamide
CID 47155694
N-(4-methyl-3-sulfamoylphenyl)-2-(prop-2-enylamino)acetamide
CID 78912240
2-[(4-methylphenyl)methylsulfanyl]-N-(4-methyl-3-sulfamoylphenyl)acetamide
CID 9141145
N-(4-methyl-3-sulfamoylphenyl)-3-propoxypropanamide
CID 62716850
3-(benzenesulfonamido)-N-(4-methyl-3-sulfamoylphenyl)propanamide
CID 18268034
2-(3,4-dichlorophenyl)-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide
CID 9107151
N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide
CID 9141000

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
The IUPAC name of 2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide (CID 18277249) is 2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide is CC(=O)Nc1ccc(CC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1.
What is the InChIKey of 2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
The InChIKey is DQNKWHRCFWSBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O4S/c1-11-3-6-15(10-16(11)25(18,23)24)20-17(22)9-13-4-7-14(8-5-13)19-12(2)21/h3-8,10H,9H2,1-2H3,(H,19,21)(H,20,22)(H2,18,23,24).
What are the key properties of 2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide?
2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide has a molecular weight of 361.42 g/mol, XLogP of 1.78, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidophenyl)-N-(4-methyl-3-sulfamoylphenyl)acetamide is sourced from PubChem (CID 18277249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).