2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide

C17H20N2O5S — CID 112998742

IUPAC2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CNS(=O)(=O)c2ccc(OC)c(C)c2)cc1
InChIInChI=1S/C17H20N2O5S/c1-12-10-15(8-9-16(12)24-3)25(21,22)18-11-17(20)19-13-4-6-14(23-2)7-5-13/h4-10,18H,11H2,1-3H3,(H,19,20)
InChIKeyJKTJUYRVSVUIPB-UHFFFAOYSA-N
MW364.42 g/mol
LogP1.93
Rot. Bonds7

About 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide

2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide (PubChem CID 112998742) has the molecular formula C17H20N2O5S and a molecular weight of 364.42 g/mol. Its IUPAC name is 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide
PubChem CID112998742
Molecular FormulaC17H20N2O5S
Molecular Weight364.42 g/mol
Exact Mass364.11
IUPAC Name2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CNS(=O)(=O)c2ccc(OC)c(C)c2)cc1
InChIInChI=1S/C17H20N2O5S/c1-12-10-15(8-9-16(12)24-3)25(21,22)18-11-17(20)19-13-4-6-14(23-2)7-5-13/h4-10,18H,11H2,1-3H3,(H,19,20)
InChIKeyJKTJUYRVSVUIPB-UHFFFAOYSA-N
XLogP1.93
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide (CID 112998742) is 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)CNS(=O)(=O)c2ccc(OC)c(C)c2)cc1.
What is the InChIKey of 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide?
The InChIKey is JKTJUYRVSVUIPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5S/c1-12-10-15(8-9-16(12)24-3)25(21,22)18-11-17(20)19-13-4-6-14(23-2)7-5-13/h4-10,18H,11H2,1-3H3,(H,19,20).
What are the key properties of 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide?
2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide has a molecular weight of 364.42 g/mol, XLogP of 1.93, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 112998742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).