2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide

C18H22N2O5S — CID 1294283

IUPAC2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN(C)S(=O)(=O)c1cc(C)ccc1OC
InChIInChI=1S/C18H22N2O5S/c1-13-9-10-16(25-4)17(11-13)26(22,23)20(2)12-18(21)19-14-7-5-6-8-15(14)24-3/h5-11H,12H2,1-4H3,(H,19,21)
InChIKeySIESRPNEZPNRGY-UHFFFAOYSA-N
MW378.45 g/mol
LogP2.27
Rot. Bonds7

About 2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide

2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide (PubChem CID 1294283) has the molecular formula C18H22N2O5S and a molecular weight of 378.45 g/mol. Its IUPAC name is 2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide
PubChem CID1294283
Molecular FormulaC18H22N2O5S
Molecular Weight378.45 g/mol
Exact Mass378.12
IUPAC Name2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN(C)S(=O)(=O)c1cc(C)ccc1OC
InChIInChI=1S/C18H22N2O5S/c1-13-9-10-16(25-4)17(11-13)26(22,23)20(2)12-18(21)19-14-7-5-6-8-15(14)24-3/h5-11H,12H2,1-4H3,(H,19,21)
InChIKeySIESRPNEZPNRGY-UHFFFAOYSA-N
XLogP2.27
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.45
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide (CID 1294283) is 2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)CN(C)S(=O)(=O)c1cc(C)ccc1OC.
What is the InChIKey of 2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide?
The InChIKey is SIESRPNEZPNRGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O5S/c1-13-9-10-16(25-4)17(11-13)26(22,23)20(2)12-18(21)19-14-7-5-6-8-15(14)24-3/h5-11H,12H2,1-4H3,(H,19,21).
What are the key properties of 2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide?
2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide has a molecular weight of 378.45 g/mol, XLogP of 2.27, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 1294283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).