2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide

C24H26N2O4S — CID 998364

IUPAC2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide
SMILESCCc1ccccc1N(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C24H26N2O4S/c1-4-19-8-5-6-11-23(19)26(31(28,29)22-14-12-18(2)13-15-22)17-24(27)25-20-9-7-10-21(16-20)30-3/h5-16H,4,17H2,1-3H3,(H,25,27)
InChIKeyMWWLMGWSLUAJFF-UHFFFAOYSA-N
MW438.55 g/mol
LogP4.40
Rot. Bonds8

About 2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide

2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide (PubChem CID 998364) has the molecular formula C24H26N2O4S and a molecular weight of 438.55 g/mol. Its IUPAC name is 2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide
PubChem CID998364
Molecular FormulaC24H26N2O4S
Molecular Weight438.55 g/mol
Exact Mass438.16
IUPAC Name2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide
SMILESCCc1ccccc1N(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C24H26N2O4S/c1-4-19-8-5-6-11-23(19)26(31(28,29)22-14-12-18(2)13-15-22)17-24(27)25-20-9-7-10-21(16-20)30-3/h5-16H,4,17H2,1-3H3,(H,25,27)
InChIKeyMWWLMGWSLUAJFF-UHFFFAOYSA-N
XLogP4.40
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.55
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide (CID 998364) is 2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide is CCc1ccccc1N(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccc(C)cc1.
What is the InChIKey of 2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide?
The InChIKey is MWWLMGWSLUAJFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4S/c1-4-19-8-5-6-11-23(19)26(31(28,29)22-14-12-18(2)13-15-22)17-24(27)25-20-9-7-10-21(16-20)30-3/h5-16H,4,17H2,1-3H3,(H,25,27).
What are the key properties of 2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide?
2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide has a molecular weight of 438.55 g/mol, XLogP of 4.40, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 998364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).