2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide

C17H20N2O3S — CID 26941914

IUPAC2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cccc(C)c1NC(=O)CN(C)S(=O)(=O)c1ccccc1
InChIInChI=1S/C17H20N2O3S/c1-13-8-7-9-14(2)17(13)18-16(20)12-19(3)23(21,22)15-10-5-4-6-11-15/h4-11H,12H2,1-3H3,(H,18,20)
InChIKeyFSNNDJUYZANPCT-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.56
Rot. Bonds5

About 2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide

2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide (PubChem CID 26941914) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is 2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide
PubChem CID26941914
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC Name2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide
SMILESCc1cccc(C)c1NC(=O)CN(C)S(=O)(=O)c1ccccc1
InChIInChI=1S/C17H20N2O3S/c1-13-8-7-9-14(2)17(13)18-16(20)12-19(3)23(21,22)15-10-5-4-6-11-15/h4-11H,12H2,1-3H3,(H,18,20)
InChIKeyFSNNDJUYZANPCT-UHFFFAOYSA-N
XLogP2.56
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-dimethylphenyl)-2-[methyl-(4-phenylphenyl)sulfonylamino]acetamide
CID 55908373
2-[benzenesulfonyl(methyl)amino]-N-(2-ethyl-6-methylphenyl)acetamide
CID 891784
2-[(3,5-dichlorophenyl)sulfonyl-methylamino]-N-(2,6-dimethylphenyl)acetamide
CID 26941934
2-[benzenesulfonyl(ethyl)amino]-N-(2,6-dimethylphenyl)acetamide
CID 3877866
2-[methyl-(4-methylphenyl)sulfonylamino]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 3880241
2-[benzenesulfonyl(2-phenylethyl)amino]-N-(2,6-dimethylphenyl)acetamide
CID 1123794
N-(2,6-dimethylphenyl)-2-[methyl-[(E)-2-phenylethenyl]sulfonylamino]acetamide
CID 40682649
2-[N-(benzenesulfonyl)-2,4-dimethylanilino]-N-(2,6-dimethylphenyl)acetamide
CID 1095221
2-[N-(benzenesulfonyl)-3,4-dimethylanilino]-N-(2,6-dimethylphenyl)acetamide
CID 51345251
2-[methyl-(4-methylphenyl)sulfonylamino]-N-phenylacetamide
CID 2178261
2-[(4-chloro-3-cyanophenyl)sulfonyl-methylamino]-N-(2,6-dimethylphenyl)acetamide
CID 55729086
N-(2,3-dimethylphenyl)-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide
CID 925267

Frequently Asked Questions

What is the IUPAC name of 2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide?
The IUPAC name of 2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide (CID 26941914) is 2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide.
What is the SMILES notation for 2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide?
The canonical SMILES for 2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide is Cc1cccc(C)c1NC(=O)CN(C)S(=O)(=O)c1ccccc1.
What is the InChIKey of 2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide?
The InChIKey is FSNNDJUYZANPCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-13-8-7-9-14(2)17(13)18-16(20)12-19(3)23(21,22)15-10-5-4-6-11-15/h4-11H,12H2,1-3H3,(H,18,20).
What are the key properties of 2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide?
2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide has a molecular weight of 332.43 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzenesulfonyl(methyl)amino]-N-(2,6-dimethylphenyl)acetamide is sourced from PubChem (CID 26941914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).