N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide

C22H22N2O3S — CID 22306495

IUPACN-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide
SMILESCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)c2ccccc2C)cc1
InChIInChI=1S/C22H22N2O3S/c1-3-17-9-5-7-11-21(17)24-28(26,27)19-14-12-18(13-15-19)23-22(25)20-10-6-4-8-16(20)2/h4-15,24H,3H2,1-2H3,(H,23,25)
InChIKeyNHJYSROYZJXHMJ-UHFFFAOYSA-N
MW394.50 g/mol
LogP4.61
Rot. Bonds6

About N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide

N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide (PubChem CID 22306495) has the molecular formula C22H22N2O3S and a molecular weight of 394.50 g/mol. Its IUPAC name is N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide
PubChem CID22306495
Molecular FormulaC22H22N2O3S
Molecular Weight394.50 g/mol
Exact Mass394.14
IUPAC NameN-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide
SMILESCCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)c2ccccc2C)cc1
InChIInChI=1S/C22H22N2O3S/c1-3-17-9-5-7-11-21(17)24-28(26,27)19-14-12-18(13-15-19)23-22(25)20-10-6-4-8-16(20)2/h4-15,24H,3H2,1-2H3,(H,23,25)
InChIKeyNHJYSROYZJXHMJ-UHFFFAOYSA-N
XLogP4.61
TPSA75.27 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 ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 1333349
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide
CID 4933955
N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-methylbenzamide
CID 40575887
N-[4-(butylsulfamoyl)phenyl]-2-methylbenzamide
CID 4278982
N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-nitrobenzamide
CID 997658
N-(2,6-diethylphenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 3521473
4-[(2-methylbenzoyl)amino]benzenesulfonyl chloride
CID 13467302
N-(4-ethylphenyl)-5-[(2-fluorophenyl)sulfamoyl]-2-methylbenzamide
CID 26697270
N-(4-iodophenyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 126385456
N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-phenylacetamide
CID 22306588
2-methyl-N-[4-methyl-2-[(4-methylphenyl)sulfonylamino]phenyl]benzamide
CID 169370457
N-[4-(diethylamino)phenyl]-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 27229309

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide?
The IUPAC name of N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide (CID 22306495) is N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide.
What is the SMILES notation for N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide?
The canonical SMILES for N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide is CCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)c2ccccc2C)cc1.
What is the InChIKey of N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide?
The InChIKey is NHJYSROYZJXHMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O3S/c1-3-17-9-5-7-11-21(17)24-28(26,27)19-14-12-18(13-15-19)23-22(25)20-10-6-4-8-16(20)2/h4-15,24H,3H2,1-2H3,(H,23,25).
What are the key properties of N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide?
N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide has a molecular weight of 394.50 g/mol, XLogP of 4.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide is sourced from PubChem (CID 22306495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).