N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide

C23H24N2O3S — CID 126363159

IUPACN-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide
SMILESCc1ccc(NS(=O)(=O)c2ccc(CCC(=O)Nc3cccc(C)c3)cc2)cc1
InChIInChI=1S/C23H24N2O3S/c1-17-6-11-20(12-7-17)25-29(27,28)22-13-8-19(9-14-22)10-15-23(26)24-21-5-3-4-18(2)16-21/h3-9,11-14,16,25H,10,15H2,1-2H3,(H,24,26)
InChIKeyLHUJYPPNWMQVNN-UHFFFAOYSA-N
MW408.52 g/mol
LogP4.68
Rot. Bonds7

About N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide

N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide (PubChem CID 126363159) has the molecular formula C23H24N2O3S and a molecular weight of 408.52 g/mol. Its IUPAC name is N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide.

Molecular Properties

Compound NameN-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide
PubChem CID126363159
Molecular FormulaC23H24N2O3S
Molecular Weight408.52 g/mol
Exact Mass408.15
IUPAC NameN-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide
SMILESCc1ccc(NS(=O)(=O)c2ccc(CCC(=O)Nc3cccc(C)c3)cc2)cc1
InChIInChI=1S/C23H24N2O3S/c1-17-6-11-20(12-7-17)25-29(27,28)22-13-8-19(9-14-22)10-15-23(26)24-21-5-3-4-18(2)16-21/h3-9,11-14,16,25H,10,15H2,1-2H3,(H,24,26)
InChIKeyLHUJYPPNWMQVNN-UHFFFAOYSA-N
XLogP4.68
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.52
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromophenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide
CID 126367263
4-[3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanoylamino]benzamide
CID 126368002
3-[4-[(4-methylphenyl)sulfamoyl]phenyl]-N-[4-(trifluoromethyl)phenyl]propanamide
CID 2234602
3-[4-[(4-methylphenyl)sulfamoyl]phenyl]-N-propan-2-ylpropanamide
CID 126356786
N-(2-methoxyphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide
CID 1254823
methyl 5-[3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanoylamino]-1-benzothiophene-2-carboxylate
CID 28557273
N-[3-(bromomethyl)phenyl]-3-(4-methylphenyl)propanamide
CID 114307276
N-[4-[(4-methylphenyl)sulfonylamino]phenyl]butanamide
CID 4581682
4-methyl-N-[4-(3-methylanilino)phenyl]benzenesulfonamide
CID 112985985
4-(3-hydroxypropyl)-N-(3-methylphenyl)benzenesulfonamide
CID 39436095
4-methyl-N-(3-methylphenyl)benzenesulfonamide fluoride
CID 21210525
N,3-bis(4-methylphenyl)propanamide
CID 19220434

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide?
The IUPAC name of N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide (CID 126363159) is N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide.
What is the SMILES notation for N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide?
The canonical SMILES for N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide is Cc1ccc(NS(=O)(=O)c2ccc(CCC(=O)Nc3cccc(C)c3)cc2)cc1.
What is the InChIKey of N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide?
The InChIKey is LHUJYPPNWMQVNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3S/c1-17-6-11-20(12-7-17)25-29(27,28)22-13-8-19(9-14-22)10-15-23(26)24-21-5-3-4-18(2)16-21/h3-9,11-14,16,25H,10,15H2,1-2H3,(H,24,26).
What are the key properties of N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide?
N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide has a molecular weight of 408.52 g/mol, XLogP of 4.68, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-3-[4-[(4-methylphenyl)sulfamoyl]phenyl]propanamide is sourced from PubChem (CID 126363159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).