N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide

C23H24N2O4S — CID 1004335

IUPACN-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide
SMILESCCOc1ccccc1NC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C23H24N2O4S/c1-3-29-22-12-8-7-11-21(22)24-23(26)17-25(19-9-5-4-6-10-19)30(27,28)20-15-13-18(2)14-16-20/h4-16H,3,17H2,1-2H3,(H,24,26)
InChIKeyBYNNWCTWGCIIEV-UHFFFAOYSA-N
MW424.52 g/mol
LogP4.23
Rot. Bonds8

About N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide

N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide (PubChem CID 1004335) has the molecular formula C23H24N2O4S and a molecular weight of 424.52 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide
PubChem CID1004335
Molecular FormulaC23H24N2O4S
Molecular Weight424.52 g/mol
Exact Mass424.15
IUPAC NameN-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide
SMILESCCOc1ccccc1NC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C23H24N2O4S/c1-3-29-22-12-8-7-11-21(22)24-23(26)17-25(19-9-5-4-6-10-19)30(27,28)20-15-13-18(2)14-16-20/h4-16H,3,17H2,1-2H3,(H,24,26)
InChIKeyBYNNWCTWGCIIEV-UHFFFAOYSA-N
XLogP4.23
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.52
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide (CID 1004335) is N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide is CCOc1ccccc1NC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(C)cc1.
What is the InChIKey of N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide?
The InChIKey is BYNNWCTWGCIIEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4S/c1-3-29-22-12-8-7-11-21(22)24-23(26)17-25(19-9-5-4-6-10-19)30(27,28)20-15-13-18(2)14-16-20/h4-16H,3,17H2,1-2H3,(H,24,26).
What are the key properties of N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide?
N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide has a molecular weight of 424.52 g/mol, XLogP of 4.23, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-(N-(4-methylphenyl)sulfonylanilino)acetamide is sourced from PubChem (CID 1004335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).