2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide

C22H22N2O3S — CID 4787027

IUPAC2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide
SMILESCC(NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C22H22N2O3S/c1-16(17-12-14-20(15-13-17)28(23,26)27)24-22(25)21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-16,21H,1H3,(H,24,25)(H2,23,26,27)
InChIKeyOCZQBYDDHFRZKL-UHFFFAOYSA-N
MW394.50 g/mol
LogP3.34
Rot. Bonds6

About 2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide

2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide (PubChem CID 4787027) has the molecular formula C22H22N2O3S and a molecular weight of 394.50 g/mol. Its IUPAC name is 2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide
PubChem CID4787027
Molecular FormulaC22H22N2O3S
Molecular Weight394.50 g/mol
Exact Mass394.14
IUPAC Name2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide
SMILESCC(NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C22H22N2O3S/c1-16(17-12-14-20(15-13-17)28(23,26)27)24-22(25)21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-16,21H,1H3,(H,24,25)(H2,23,26,27)
InChIKeyOCZQBYDDHFRZKL-UHFFFAOYSA-N
XLogP3.34
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.50
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide?
The IUPAC name of 2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide (CID 4787027) is 2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide.
What is the SMILES notation for 2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide?
The canonical SMILES for 2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide is CC(NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide?
The InChIKey is OCZQBYDDHFRZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O3S/c1-16(17-12-14-20(15-13-17)28(23,26)27)24-22(25)21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-16,21H,1H3,(H,24,25)(H2,23,26,27).
What are the key properties of 2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide?
2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide has a molecular weight of 394.50 g/mol, XLogP of 3.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-N-[1-(4-sulfamoylphenyl)ethyl]acetamide is sourced from PubChem (CID 4787027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).