N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide

C29H28N2O3S — CID 25190837

IUPACN-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide
SMILESO=C(C1CCCC1)n1c(-c2ccc3c(c2)CC(NS(=O)(=O)c2ccccc2)C3)cc2ccccc21
InChIInChI=1S/C29H28N2O3S/c32-29(20-8-4-5-9-20)31-27-13-7-6-10-22(27)19-28(31)23-15-14-21-17-25(18-24(21)16-23)30-35(33,34)26-11-2-1-3-12-26/h1-3,6-7,10-16,19-20,25,30H,4-5,8-9,17-18H2
InChIKeyGOFKZQPHWQEKAE-UHFFFAOYSA-N
MW484.62 g/mol
LogP5.58
Rot. Bonds5

About N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide

N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide (PubChem CID 25190837) has the molecular formula C29H28N2O3S and a molecular weight of 484.62 g/mol. Its IUPAC name is N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide.

Molecular Properties

Compound NameN-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide
PubChem CID25190837
Molecular FormulaC29H28N2O3S
Molecular Weight484.62 g/mol
Exact Mass484.18
IUPAC NameN-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide
SMILESO=C(C1CCCC1)n1c(-c2ccc3c(c2)CC(NS(=O)(=O)c2ccccc2)C3)cc2ccccc21
InChIInChI=1S/C29H28N2O3S/c32-29(20-8-4-5-9-20)31-27-13-7-6-10-22(27)19-28(31)23-15-14-21-17-25(18-24(21)16-23)30-35(33,34)26-11-2-1-3-12-26/h1-3,6-7,10-16,19-20,25,30H,4-5,8-9,17-18H2
InChIKeyGOFKZQPHWQEKAE-UHFFFAOYSA-N
XLogP5.58
TPSA68.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.62
LogP ≤ 55.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide 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

Indole derivative, 5o
CID 17753624
tert-butyl 2-(2-benzenesulfonamido-2,3-dihydro-1H-inden-5-yl)-1H-indole-1-carboxylate
CID 25190792
tert-butyl 2-(2-benzenesulfonamido-2,3-dihydro-1H-inden-5-yl)-6-methyl-1H-indole-1-carboxylate
CID 25190825
tert-butyl 2-[(2R)-2-benzenesulfonamido-2,3-dihydro-1H-inden-5-yl]-1H-indole-1-carboxylate
CID 25190827
tert-butyl 2-[(2S)-2-benzenesulfonamido-2,3-dihydro-1H-inden-5-yl]-1H-indole-1-carboxylate
CID 25190828
Indole derivative, 5b
CID 25190847
Indole derivative, 5c
CID 25190848
Indole derivative, 5d
CID 25190849
Indole derivative, 5e
CID 25190850
Indole derivative, 5i
CID 25190854
Indole derivative, 5l
CID 25190857
Indole derivative, 5n
CID 25190859

Frequently Asked Questions

What is the IUPAC name of N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide?
The IUPAC name of N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide (CID 25190837) is N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide.
What is the SMILES notation for N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide?
The canonical SMILES for N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide is O=C(C1CCCC1)n1c(-c2ccc3c(c2)CC(NS(=O)(=O)c2ccccc2)C3)cc2ccccc21.
What is the InChIKey of N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide?
The InChIKey is GOFKZQPHWQEKAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H28N2O3S/c32-29(20-8-4-5-9-20)31-27-13-7-6-10-22(27)19-28(31)23-15-14-21-17-25(18-24(21)16-23)30-35(33,34)26-11-2-1-3-12-26/h1-3,6-7,10-16,19-20,25,30H,4-5,8-9,17-18H2.
What are the key properties of N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide?
N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide has a molecular weight of 484.62 g/mol, XLogP of 5.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[1-(cyclopentanecarbonyl)indol-2-yl]-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide is sourced from PubChem (CID 25190837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).