N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide

C23H28N2O3S — CID 56517187

IUPACN-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide
SMILESCC(C)N(C(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1)C1CCCC1
InChIInChI=1S/C23H28N2O3S/c1-17(2)25(20-10-4-5-11-20)23(26)19-9-7-12-21(16-19)29(27,28)24-15-14-18-8-3-6-13-22(18)24/h3,6-9,12-13,16-17,20H,4-5,10-11,14-15H2,1-2H3
InChIKeyGQSMUKGOHCHVPE-UHFFFAOYSA-N
MW412.56 g/mol
LogP4.23
Rot. Bonds5

About N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide

N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide (PubChem CID 56517187) has the molecular formula C23H28N2O3S and a molecular weight of 412.56 g/mol. Its IUPAC name is N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide
PubChem CID56517187
Molecular FormulaC23H28N2O3S
Molecular Weight412.56 g/mol
Exact Mass412.18
IUPAC NameN-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide
SMILESCC(C)N(C(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1)C1CCCC1
InChIInChI=1S/C23H28N2O3S/c1-17(2)25(20-10-4-5-11-20)23(26)19-9-7-12-21(16-19)29(27,28)24-15-14-18-8-3-6-13-22(18)24/h3,6-9,12-13,16-17,20H,4-5,10-11,14-15H2,1-2H3
InChIKeyGQSMUKGOHCHVPE-UHFFFAOYSA-N
XLogP4.23
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.56
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2,3-dihydroindol-1-ylsulfonyl)-N-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 56504051
3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-N-methyl-N-(2-methylpropyl)benzamide
CID 134057952
3-(2,3-dihydroindol-1-ylsulfonyl)benzoate
CID 7062520
[2-(cyclohexylamino)-2-oxoethyl] 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate
CID 2551475
(4-methoxyphenyl) 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate
CID 8881484
3-(2,3-dihydroindol-1-ylsulfonyl)-N-[4-(N-propan-2-ylanilino)phenyl]benzamide
CID 2509035
[2-[methyl-(4-methylcyclohexyl)amino]-2-oxoethyl] 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate
CID 43028156
2-oxopropyl 3-(2,3-dihydroindol-1-ylsulfonyl)benzoate
CID 5122086
N-(2-benzamidoethyl)-3-(2,3-dihydroindol-1-ylsulfonyl)benzamide
CID 55549519
methyl (2S,3aR,7aR)-1-[3-(2,3-dihydroindol-1-ylsulfonyl)benzoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylate
CID 124742576
3-(2,3-dihydroindol-1-ylsulfonyl)-N-(4-methylpiperazin-4-ium-1-yl)benzamide
CID 9204709
3-(2,3-dihydroindol-1-ylsulfonyl)-N-(2-propan-2-ylphenyl)benzamide
CID 7958230

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide?
The IUPAC name of N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide (CID 56517187) is N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide.
What is the SMILES notation for N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide?
The canonical SMILES for N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide is CC(C)N(C(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide?
The InChIKey is GQSMUKGOHCHVPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3S/c1-17(2)25(20-10-4-5-11-20)23(26)19-9-7-12-21(16-19)29(27,28)24-15-14-18-8-3-6-13-22(18)24/h3,6-9,12-13,16-17,20H,4-5,10-11,14-15H2,1-2H3.
What are the key properties of N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide?
N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide has a molecular weight of 412.56 g/mol, XLogP of 4.23, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(2,3-dihydroindol-1-ylsulfonyl)-N-propan-2-ylbenzamide is sourced from PubChem (CID 56517187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).