4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide

C23H24N2O3S — CID 132663227

IUPAC4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide
SMILESCCC(NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1)c1ccccc1C
InChIInChI=1S/C23H24N2O3S/c1-3-22(21-12-8-7-9-17(21)2)24-23(26)18-13-15-19(16-14-18)25-29(27,28)20-10-5-4-6-11-20/h4-16,22,25H,3H2,1-2H3,(H,24,26)
InChIKeyAPEWHVDIMFKEOQ-UHFFFAOYSA-N
MW408.52 g/mol
LogP4.68
Rot. Bonds7

About 4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide

4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide (PubChem CID 132663227) has the molecular formula C23H24N2O3S and a molecular weight of 408.52 g/mol. Its IUPAC name is 4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide.

Molecular Properties

Compound Name4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide
PubChem CID132663227
Molecular FormulaC23H24N2O3S
Molecular Weight408.52 g/mol
Exact Mass408.15
IUPAC Name4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide
SMILESCCC(NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1)c1ccccc1C
InChIInChI=1S/C23H24N2O3S/c1-3-22(21-12-8-7-9-17(21)2)24-23(26)18-13-15-19(16-14-18)25-29(27,28)20-10-5-4-6-11-20/h4-16,22,25H,3H2,1-2H3,(H,24,26)
InChIKeyAPEWHVDIMFKEOQ-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

4-(benzenesulfonamido)-N-[2-methyl-1-(2-methylphenyl)propyl]benzamide
CID 132666924
N-[1-(2,4-dimethylphenyl)propyl]-4-(ethylsulfonylamino)benzamide
CID 132656310
4-(benzenesulfonamido)-N-(1-methoxypropan-2-yl)benzamide
CID 6459980
methyl 3-[[4-[(3,4-dimethylphenyl)sulfamoyl]benzoyl]amino]-3-phenylpropanoate
CID 24516849
4-(benzenesulfonamido)-N-(1-cyclopropylethyl)benzamide
CID 84975243
4-(benzenesulfonamido)-N-(2,3-dimethylphenyl)benzamide
CID 1252770
4-(benzenesulfonamido)-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]benzamide
CID 17052595
4-(benzenesulfonamido)-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide
CID 20666691
4-(methanesulfonamido)-N-[(S)-(2-methylphenyl)-phenylmethyl]benzamide
CID 92678214
4-(benzenesulfonamido)-N-(3,4-diethoxyphenyl)benzamide
CID 43009389
4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-[(1R)-1-(2-methylphenyl)propyl]benzamide
CID 100586569
4-(benzenesulfonamido)-N-(4-butylphenyl)benzamide
CID 2231369

Frequently Asked Questions

What is the IUPAC name of 4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide?
The IUPAC name of 4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide (CID 132663227) is 4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide.
What is the SMILES notation for 4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide?
The canonical SMILES for 4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide is CCC(NC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1)c1ccccc1C.
What is the InChIKey of 4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide?
The InChIKey is APEWHVDIMFKEOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3S/c1-3-22(21-12-8-7-9-17(21)2)24-23(26)18-13-15-19(16-14-18)25-29(27,28)20-10-5-4-6-11-20/h4-16,22,25H,3H2,1-2H3,(H,24,26).
What are the key properties of 4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide?
4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide 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 4-(benzenesulfonamido)-N-[1-(2-methylphenyl)propyl]benzamide is sourced from PubChem (CID 132663227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).