2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide

C17H21N3O4S — CID 3363391

IUPAC2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C17H21N3O4S/c1-19(2)25(22,23)20(15-7-5-4-6-8-15)13-17(21)18-14-9-11-16(24-3)12-10-14/h4-12H,13H2,1-3H3,(H,18,21)
InChIKeyUQYCHIONXDUAEB-UHFFFAOYSA-N
MW363.44 g/mol
LogP1.95
Rot. Bonds7

About 2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide

2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide (PubChem CID 3363391) has the molecular formula C17H21N3O4S and a molecular weight of 363.44 g/mol. Its IUPAC name is 2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide
PubChem CID3363391
Molecular FormulaC17H21N3O4S
Molecular Weight363.44 g/mol
Exact Mass363.13
IUPAC Name2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C17H21N3O4S/c1-19(2)25(22,23)20(15-7-5-4-6-8-15)13-17(21)18-14-9-11-16(24-3)12-10-14/h4-12H,13H2,1-3H3,(H,18,21)
InChIKeyUQYCHIONXDUAEB-UHFFFAOYSA-N
XLogP1.95
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.44
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[N-(dimethylsulfamoyl)-4-fluoroanilino]-N-(4-methoxyphenyl)acetamide
CID 53283291
N-(4-methoxyphenyl)-2-(N-methylsulfonylanilino)acetamide
CID 1360894
N-(4-acetamidophenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide
CID 17201170
2-[N-(dimethylsulfamoyl)anilino]-N-[(4-methoxyphenyl)methyl]acetamide
CID 2976396
2-[N-(dimethylsulfamoyl)anilino]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 15991423
N-(4-chlorophenyl)-2-(N-(4-methoxyphenyl)sulfonylanilino)acetamide
CID 1099949
2-[N-(dimethylsulfamoyl)anilino]-N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]acetamide
CID 99949630
2-[N-(dimethylsulfamoyl)anilino]-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 53280050
2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-phenylacetamide
CID 1334368
2-(N-(4-chlorophenyl)sulfonyl-4-methoxyanilino)-N-phenylacetamide
CID 4882632
2-(2-methoxy-N-methylsulfonylanilino)-N-(4-methoxyphenyl)acetamide
CID 1334036
N-(5-chloro-2-methoxyphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide
CID 2947640

Frequently Asked Questions

What is the IUPAC name of 2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide (CID 3363391) is 2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)cc1.
What is the InChIKey of 2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide?
The InChIKey is UQYCHIONXDUAEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O4S/c1-19(2)25(22,23)20(15-7-5-4-6-8-15)13-17(21)18-14-9-11-16(24-3)12-10-14/h4-12H,13H2,1-3H3,(H,18,21).
What are the key properties of 2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide?
2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide has a molecular weight of 363.44 g/mol, XLogP of 1.95, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-(dimethylsulfamoyl)anilino]-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 3363391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).