N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide

C18H23N3O3S — CID 1211220

IUPACN-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide
SMILESCc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)cc1C
InChIInChI=1S/C18H23N3O3S/c1-14-10-11-16(12-15(14)2)19-18(22)13-21(25(23,24)20(3)4)17-8-6-5-7-9-17/h5-12H,13H2,1-4H3,(H,19,22)
InChIKeyUZFXIWCXFUJIBS-UHFFFAOYSA-N
MW361.47 g/mol
LogP2.55
Rot. Bonds6

About N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide

N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide (PubChem CID 1211220) has the molecular formula C18H23N3O3S and a molecular weight of 361.47 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide
PubChem CID1211220
Molecular FormulaC18H23N3O3S
Molecular Weight361.47 g/mol
Exact Mass361.15
IUPAC NameN-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide
SMILESCc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)cc1C
InChIInChI=1S/C18H23N3O3S/c1-14-10-11-16(12-15(14)2)19-18(22)13-21(25(23,24)20(3)4)17-8-6-5-7-9-17/h5-12H,13H2,1-4H3,(H,19,22)
InChIKeyUZFXIWCXFUJIBS-UHFFFAOYSA-N
XLogP2.55
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-Diacetylbenzidine
CID 11942
N,N'-bis(3,4-dimethylphenyl)propanediamide
CID 228389
N,N'-DI(O-Tolyl)oxamide
CID 223396
N,N'-9H-Fluorene-2,7-diylbis(acetamide)
CID 9352
4',4''-Methylenebis(acetanilide)
CID 94990
N-(4-Bromo-phenyl)-2-(3,4-dimethyl-phenylamino)-acetamide
CID 832423
2-[4-(2-fluorophenyl)piperidin-1-yl]-N-(m-tolyl)acetamide
CID 10359019
2-(4-benzyl-1-piperazinyl)-N-phenylacetamide
CID 934745
N-(3,5-dimethylphenyl)-2-(4-phenylpiperazin-1-yl)acetamide
CID 3157325
Leucine-beta-naphthylamide
CID 102475
Glycine beta-naphthylamide
CID 3013990
N-(biphenyl-3-yl)-6-(sulfamoylamino)hexanamide
CID 23634372

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide?
The IUPAC name of N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide (CID 1211220) is N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide is Cc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide?
The InChIKey is UZFXIWCXFUJIBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3S/c1-14-10-11-16(12-15(14)2)19-18(22)13-21(25(23,24)20(3)4)17-8-6-5-7-9-17/h5-12H,13H2,1-4H3,(H,19,22).
What are the key properties of N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide?
N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide has a molecular weight of 361.47 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-2-[N-(dimethylsulfamoyl)anilino]acetamide is sourced from PubChem (CID 1211220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).