2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide

C18H22N2O5S — CID 112998681

IUPAC2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CNS(=O)(=O)c2cc(C)c(OC)cc2C)c1
InChIInChI=1S/C18H22N2O5S/c1-12-9-17(13(2)8-16(12)25-4)26(22,23)19-11-18(21)20-14-6-5-7-15(10-14)24-3/h5-10,19H,11H2,1-4H3,(H,20,21)
InChIKeyZSJJAJMLRAGWFL-UHFFFAOYSA-N
MW378.45 g/mol
LogP2.24
Rot. Bonds7

About 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide

2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide (PubChem CID 112998681) has the molecular formula C18H22N2O5S and a molecular weight of 378.45 g/mol. Its IUPAC name is 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
PubChem CID112998681
Molecular FormulaC18H22N2O5S
Molecular Weight378.45 g/mol
Exact Mass378.12
IUPAC Name2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CNS(=O)(=O)c2cc(C)c(OC)cc2C)c1
InChIInChI=1S/C18H22N2O5S/c1-12-9-17(13(2)8-16(12)25-4)26(22,23)19-11-18(21)20-14-6-5-7-15(10-14)24-3/h5-10,19H,11H2,1-4H3,(H,20,21)
InChIKeyZSJJAJMLRAGWFL-UHFFFAOYSA-N
XLogP2.24
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.45
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-fluorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide
CID 113000475
N-(3,4-dimethylphenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide
CID 112996580
2-[(2-methoxy-5-methylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998674
2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998662
N-(4-chlorophenyl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide
CID 112997944
N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide
CID 112999711
N-(3-acetylphenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide
CID 112999558
N-(1,3-benzodioxol-5-yl)-2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]acetamide
CID 110370507
2-[(4-tert-butylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998694
2-[(4-acetamidophenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998688
2-[(2,6-dimethylphenyl)methylsulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 22300171
2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]-N-(4-methylphenyl)acetamide
CID 112996215

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide (CID 112998681) is 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)CNS(=O)(=O)c2cc(C)c(OC)cc2C)c1.
What is the InChIKey of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide?
The InChIKey is ZSJJAJMLRAGWFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O5S/c1-12-9-17(13(2)8-16(12)25-4)26(22,23)19-11-18(21)20-14-6-5-7-15(10-14)24-3/h5-10,19H,11H2,1-4H3,(H,20,21).
What are the key properties of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide?
2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide has a molecular weight of 378.45 g/mol, XLogP of 2.24, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 112998681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).