N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide

C22H22N2O3S — CID 17145886

IUPACN-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide
SMILESCc1ccccc1CC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1
InChIInChI=1S/C22H22N2O3S/c1-17-7-5-6-10-19(17)15-22(25)24-20-11-13-21(14-12-20)28(26,27)23-16-18-8-3-2-4-9-18/h2-14,23H,15-16H2,1H3,(H,24,25)
InChIKeyIUSQGQFWLGTKOI-UHFFFAOYSA-N
MW394.50 g/mol
LogP3.65
Rot. Bonds7

About N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide

N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide (PubChem CID 17145886) has the molecular formula C22H22N2O3S and a molecular weight of 394.50 g/mol. Its IUPAC name is N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide
PubChem CID17145886
Molecular FormulaC22H22N2O3S
Molecular Weight394.50 g/mol
Exact Mass394.14
IUPAC NameN-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide
SMILESCc1ccccc1CC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1
InChIInChI=1S/C22H22N2O3S/c1-17-7-5-6-10-19(17)15-22(25)24-20-11-13-21(14-12-20)28(26,27)23-16-18-8-3-2-4-9-18/h2-14,23H,15-16H2,1H3,(H,24,25)
InChIKeyIUSQGQFWLGTKOI-UHFFFAOYSA-N
XLogP3.65
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.50
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylphenyl)-N-[4-(2-phenylethylsulfamoyl)phenyl]acetamide
CID 17145873
N-[4-(butan-2-ylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide
CID 43877406
N-[4-(benzylsulfamoyl)phenyl]-3-(2-chlorophenyl)propanamide
CID 17178995
N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-phenylacetamide
CID 22306588
N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenoxy)propanamide
CID 4931586
N-[4-(benzylsulfamoyl)phenyl]octanamide
CID 4958608
N-[4-(benzylsulfamoyl)phenyl]-2-(3,4-dimethylphenoxy)acetamide
CID 4931030
1-N,4-N-bis[4-(benzylsulfamoyl)phenyl]benzene-1,4-dicarboxamide
CID 4929117
N-[4-(benzylsulfamoyl)phenyl]-4-chlorobutanamide
CID 17160967
N-[4-(benzenesulfonamidomethyl)phenyl]acetamide
CID 32683830
N-[4-(benzylsulfamoyl)phenyl]-2-(5,7-dimethyl-1,2-benzoxazol-3-yl)acetamide
CID 108806213
N-[4-(benzylsulfamoyl)phenyl]-2-(4,6-dimethyl-1,2-benzoxazol-3-yl)acetamide
CID 108806054

Frequently Asked Questions

What is the IUPAC name of N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide?
The IUPAC name of N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide (CID 17145886) is N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide.
What is the SMILES notation for N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide?
The canonical SMILES for N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide is Cc1ccccc1CC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1.
What is the InChIKey of N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide?
The InChIKey is IUSQGQFWLGTKOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O3S/c1-17-7-5-6-10-19(17)15-22(25)24-20-11-13-21(14-12-20)28(26,27)23-16-18-8-3-2-4-9-18/h2-14,23H,15-16H2,1H3,(H,24,25).
What are the key properties of N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide?
N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide has a molecular weight of 394.50 g/mol, XLogP of 3.65, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 17145886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).