2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide

C23H23N3O5S — CID 24524423

IUPAC2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide
SMILESCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)c2ccccc2OCC(N)=O)cc1
InChIInChI=1S/C23H23N3O5S/c1-26(15-17-7-3-2-4-8-17)32(29,30)19-13-11-18(12-14-19)25-23(28)20-9-5-6-10-21(20)31-16-22(24)27/h2-14H,15-16H2,1H3,(H2,24,27)(H,25,28)
InChIKeyYSIQEAJRFQUFHW-UHFFFAOYSA-N
MW453.52 g/mol
LogP2.62
Rot. Bonds9

About 2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide

2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide (PubChem CID 24524423) has the molecular formula C23H23N3O5S and a molecular weight of 453.52 g/mol. Its IUPAC name is 2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide.

Molecular Properties

Compound Name2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide
PubChem CID24524423
Molecular FormulaC23H23N3O5S
Molecular Weight453.52 g/mol
Exact Mass453.14
IUPAC Name2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide
SMILESCN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)c2ccccc2OCC(N)=O)cc1
InChIInChI=1S/C23H23N3O5S/c1-26(15-17-7-3-2-4-8-17)32(29,30)19-13-11-18(12-14-19)25-23(28)20-9-5-6-10-21(20)31-16-22(24)27/h2-14H,15-16H2,1H3,(H2,24,27)(H,25,28)
InChIKeyYSIQEAJRFQUFHW-UHFFFAOYSA-N
XLogP2.62
TPSA118.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.52
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-bromobenzamide
CID 1014272
N-[[4-[benzyl(methyl)sulfamoyl]phenyl]carbamothioyl]-2-(2-phenylethoxy)benzamide
CID 19628345
N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2,5-dichlorobenzamide
CID 26899296
N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2,5-dimethylbenzamide
CID 26899300
N-(4-acetylphenyl)-2-(2-amino-2-oxoethoxy)benzamide
CID 34795429
N-[[4-[benzyl(methyl)sulfamoyl]phenyl]carbamothioyl]-2-(2-methylphenoxy)acetamide
CID 4636128
2-(2-amino-2-oxoethoxy)-N-[4-(2-methoxyphenoxy)phenyl]benzamide
CID 24660239
2-[4-[benzyl(methyl)sulfamoyl]phenoxy]-N-(4-sulfamoylphenyl)acetamide
CID 126309888
2-[4-[benzyl(methyl)sulfamoyl]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 3318426
N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2,2-diphenylacetamide
CID 1014294
2-[4-[benzyl(methyl)sulfamoyl]phenoxy]-N-(4-ethoxyphenyl)acetamide
CID 3921360
2-methoxy-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide
CID 1226771

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide?
The IUPAC name of 2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide (CID 24524423) is 2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide.
What is the SMILES notation for 2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide?
The canonical SMILES for 2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide is CN(Cc1ccccc1)S(=O)(=O)c1ccc(NC(=O)c2ccccc2OCC(N)=O)cc1.
What is the InChIKey of 2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide?
The InChIKey is YSIQEAJRFQUFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O5S/c1-26(15-17-7-3-2-4-8-17)32(29,30)19-13-11-18(12-14-19)25-23(28)20-9-5-6-10-21(20)31-16-22(24)27/h2-14H,15-16H2,1H3,(H2,24,27)(H,25,28).
What are the key properties of 2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide?
2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide has a molecular weight of 453.52 g/mol, XLogP of 2.62, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-oxoethoxy)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]benzamide is sourced from PubChem (CID 24524423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).