2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide

C24H24N2O3S — CID 3925471

IUPAC2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide
SMILESCc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)N2c3ccccc3CC2C)c1
InChIInChI=1S/C24H24N2O3S/c1-16-12-13-17(2)23(14-16)30(28,29)25-21-10-6-5-9-20(21)24(27)26-18(3)15-19-8-4-7-11-22(19)26/h4-14,18,25H,15H2,1-3H3
InChIKeyFZXHPQAAWVODAQ-UHFFFAOYSA-N
MW420.53 g/mol
LogP4.70
Rot. Bonds4

About 2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide

2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide (PubChem CID 3925471) has the molecular formula C24H24N2O3S and a molecular weight of 420.53 g/mol. Its IUPAC name is 2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide
PubChem CID3925471
Molecular FormulaC24H24N2O3S
Molecular Weight420.53 g/mol
Exact Mass420.15
IUPAC Name2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide
SMILESCc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)N2c3ccccc3CC2C)c1
InChIInChI=1S/C24H24N2O3S/c1-16-12-13-17(2)23(14-16)30(28,29)25-21-10-6-5-9-20(21)24(27)26-18(3)15-19-8-4-7-11-22(19)26/h4-14,18,25H,15H2,1-3H3
InChIKeyFZXHPQAAWVODAQ-UHFFFAOYSA-N
XLogP4.70
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.53
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 1192817
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CID 1511494
1-Methyl-5-{[(phenylethyl)amino]sulfonyl}indolin-2-one
CID 3163725
Isatin sulfonamide, 16a
CID 42618287
N-Benzyl-2-(toluene-4-sulfonylamino)-benzamide
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3-[(dimethylamino)sulfonyl]-N-{2-[(4-methyl-1-piperidinyl)carbonyl]phenyl}benzamide
CID 992258
3-(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)-N-(2-isopropenylphenyl)propanamide
CID 1003709
N-(2-methylphenyl)-2-[methyl(phenylsulfonyl)amino]benzamide
CID 1006749
1-Methyl-2-oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid phenethyl-amide
CID 1094909
N-(2-Ethyl-phenyl)-4-(pyrrolidine-1-sulfonyl)-benzamide
CID 1428538
4-methyl-3-[(4-methyl-1-piperazinyl)sulfonyl]-N-phenylbenzamide
CID 6461347
4-methyl-N-phenyl-3-(phenylsulfamoyl)benzamide
CID 1246311

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide?
The IUPAC name of 2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide (CID 3925471) is 2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide.
What is the SMILES notation for 2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide?
The canonical SMILES for 2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide is Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)N2c3ccccc3CC2C)c1.
What is the InChIKey of 2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide?
The InChIKey is FZXHPQAAWVODAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3S/c1-16-12-13-17(2)23(14-16)30(28,29)25-21-10-6-5-9-20(21)24(27)26-18(3)15-19-8-4-7-11-22(19)26/h4-14,18,25H,15H2,1-3H3.
What are the key properties of 2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide?
2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide has a molecular weight of 420.53 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[2-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]benzenesulfonamide is sourced from PubChem (CID 3925471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).