3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide

C23H24N2O3S — CID 133163880

IUPAC3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide
SMILESCc1c(NS(=O)(=O)c2ccccc2)cccc1C(=O)NCC(C)c1ccccc1
InChIInChI=1S/C23H24N2O3S/c1-17(19-10-5-3-6-11-19)16-24-23(26)21-14-9-15-22(18(21)2)25-29(27,28)20-12-7-4-8-13-20/h3-15,17,25H,16H2,1-2H3,(H,24,26)
InChIKeyBZXBJRMRRCNFEH-UHFFFAOYSA-N
MW408.52 g/mol
LogP4.33
Rot. Bonds7

About 3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide

3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide (PubChem CID 133163880) has the molecular formula C23H24N2O3S and a molecular weight of 408.52 g/mol. Its IUPAC name is 3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide.

Molecular Properties

Compound Name3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide
PubChem CID133163880
Molecular FormulaC23H24N2O3S
Molecular Weight408.52 g/mol
Exact Mass408.15
IUPAC Name3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide
SMILESCc1c(NS(=O)(=O)c2ccccc2)cccc1C(=O)NCC(C)c1ccccc1
InChIInChI=1S/C23H24N2O3S/c1-17(19-10-5-3-6-11-19)16-24-23(26)21-14-9-15-22(18(21)2)25-29(27,28)20-12-7-4-8-13-20/h3-15,17,25H,16H2,1-2H3,(H,24,26)
InChIKeyBZXBJRMRRCNFEH-UHFFFAOYSA-N
XLogP4.33
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 ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-methylphenyl)sulfamoyl]-N-[(2S)-2-phenylpropyl]benzamide
CID 9164348
5-[(2-fluorophenyl)sulfamoyl]-2-methyl-N-(2-phenylpropyl)benzamide
CID 43003232
2-(ethylamino)-N-(2-phenylpropyl)benzamide
CID 63107799
3-(benzenesulfonamido)-N-[1-(4-ethoxyphenyl)ethyl]-2-methylbenzamide
CID 43875867
3-methylsulfonyl-N-(2-phenylpropyl)benzamide
CID 42894359
N-[2-(benzylcarbamoyl)phenyl]-2-methyl-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 19062457
3-(benzenesulfonamido)-N-[1-(3,4-dimethoxyphenyl)ethyl]-2-methylbenzamide
CID 43875279
4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
CID 9164353
3-(benzenesulfonamido)-N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-methylbenzamide
CID 100577379
2-[(4-chlorophenyl)sulfonylamino]-N-(2-hydroxy-2-phenylethyl)benzamide
CID 55527722
2-[(4-acetylphenyl)sulfonylamino]-N-(2-methylpropyl)benzamide
CID 18082666
2-(benzenesulfonamido)-N-(3-methyl-1-phenylbutyl)benzamide
CID 43907741

Frequently Asked Questions

What is the IUPAC name of 3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide?
The IUPAC name of 3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide (CID 133163880) is 3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide.
What is the SMILES notation for 3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide?
The canonical SMILES for 3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide is Cc1c(NS(=O)(=O)c2ccccc2)cccc1C(=O)NCC(C)c1ccccc1.
What is the InChIKey of 3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide?
The InChIKey is BZXBJRMRRCNFEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3S/c1-17(19-10-5-3-6-11-19)16-24-23(26)21-14-9-15-22(18(21)2)25-29(27,28)20-12-7-4-8-13-20/h3-15,17,25H,16H2,1-2H3,(H,24,26).
What are the key properties of 3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide?
3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide has a molecular weight of 408.52 g/mol, XLogP of 4.33, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzenesulfonamido)-2-methyl-N-(2-phenylpropyl)benzamide is sourced from PubChem (CID 133163880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).