2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide

C17H20N2O4S — CID 112998662

IUPAC2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)c1
InChIInChI=1S/C17H20N2O4S/c1-12-7-8-16(9-13(12)2)24(21,22)18-11-17(20)19-14-5-4-6-15(10-14)23-3/h4-10,18H,11H2,1-3H3,(H,19,20)
InChIKeyOYOHQUSWBFERHU-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.23
Rot. Bonds6

About 2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide

2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide (PubChem CID 112998662) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
PubChem CID112998662
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)c1
InChIInChI=1S/C17H20N2O4S/c1-12-7-8-16(9-13(12)2)24(21,22)18-11-17(20)19-14-5-4-6-15(10-14)23-3/h4-10,18H,11H2,1-3H3,(H,19,20)
InChIKeyOYOHQUSWBFERHU-UHFFFAOYSA-N
XLogP2.23
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-acetamidophenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998688
methyl 3-[[2-[(3,4-dimethylphenyl)sulfonylamino]acetyl]amino]benzoate
CID 112999907
2-[(4-tert-butylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998694
2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998681
N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide
CID 26584175
2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide
CID 112998742
2-[(2-methoxy-5-methylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998674
2-[[2-[(3,4-dimethylphenyl)sulfonylamino]acetyl]amino]-N-(3-fluorophenyl)acetamide
CID 9412305
2-[(2,6-dimethylphenyl)methylsulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 22300171
N-(3-chloro-4-methylphenyl)-2-[(3,4-dimethylphenyl)sulfonylamino]acetamide
CID 112998194
N-(3,4-dimethylphenyl)-2-[(3-methylphenyl)sulfonylamino]acetamide
CID 112996585
3-[(3,4-dimethylphenyl)sulfonylamino]-N-(4-methoxyphenyl)propanamide
CID 9412008

Frequently Asked Questions

What is the IUPAC name of 2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide (CID 112998662) is 2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)c1.
What is the InChIKey of 2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide?
The InChIKey is OYOHQUSWBFERHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-12-7-8-16(9-13(12)2)24(21,22)18-11-17(20)19-14-5-4-6-15(10-14)23-3/h4-10,18H,11H2,1-3H3,(H,19,20).
What are the key properties of 2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide?
2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide has a molecular weight of 348.42 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 112998662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).