1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole

C17H21N3O2S — CID 42282733

IUPAC1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole
SMILESCc1nn(C2CCCC2)cc1S(=O)(=O)N1CCc2ccccc21
InChIInChI=1S/C17H21N3O2S/c1-13-17(12-19(18-13)15-7-3-4-8-15)23(21,22)20-11-10-14-6-2-5-9-16(14)20/h2,5-6,9,12,15H,3-4,7-8,10-11H2,1H3
InChIKeyCXBLOMAOHZJSII-UHFFFAOYSA-N
MW331.44 g/mol
LogP3.06
Rot. Bonds3

About 1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole

1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole (PubChem CID 42282733) has the molecular formula C17H21N3O2S and a molecular weight of 331.44 g/mol. Its IUPAC name is 1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole.

Molecular Properties

Compound Name1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole
PubChem CID42282733
Molecular FormulaC17H21N3O2S
Molecular Weight331.44 g/mol
Exact Mass331.14
IUPAC Name1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole
SMILESCc1nn(C2CCCC2)cc1S(=O)(=O)N1CCc2ccccc21
InChIInChI=1S/C17H21N3O2S/c1-13-17(12-19(18-13)15-7-3-4-8-15)23(21,22)20-11-10-14-6-2-5-9-16(14)20/h2,5-6,9,12,15H,3-4,7-8,10-11H2,1H3
InChIKeyCXBLOMAOHZJSII-UHFFFAOYSA-N
XLogP3.06
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.44
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole 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

1-(4-cyclohexylphenyl)sulfonyl-2,3-dihydroindole
CID 893382
1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-2,3-dihydroindole
CID 866895
1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-2,3-dihydroindole chloride
CID 53314219
(3S)-3-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)-3,5-dimethylpyrazol-1-yl]thiolane 1,1-dioxide
CID 42478028
1-(3-methylphenyl)sulfonyl-2,3-dihydroindole
CID 5010201
N-benzyl-1-cyclopentyl-N-ethyl-3-methylpyrazole-4-sulfonamide
CID 42282581
3-(2,3-dihydroindol-1-ylsulfonyl)pyridine-2-carbonitrile
CID 106545109
3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethylbenzoic acid
CID 9235357
1-(2,3,4-trichlorophenyl)sulfonyl-2,3-dihydroindole
CID 50876146
4-(2,3-dihydroindol-1-ylsulfonyl)-N-methylbenzenesulfonamide
CID 134034304
5-[3-(2,3-dihydroindol-1-ylsulfonyl)-4-methylphenyl]-2-methyl-1,3-oxazole
CID 20958910
5-[4-(2,3-dihydroindol-1-ylsulfonyl)-5-methylthiophen-2-yl]-1,2-oxazole
CID 53079465

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole?
The IUPAC name of 1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole (CID 42282733) is 1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole.
What is the SMILES notation for 1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole?
The canonical SMILES for 1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole is Cc1nn(C2CCCC2)cc1S(=O)(=O)N1CCc2ccccc21.
What is the InChIKey of 1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole?
The InChIKey is CXBLOMAOHZJSII-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O2S/c1-13-17(12-19(18-13)15-7-3-4-8-15)23(21,22)20-11-10-14-6-2-5-9-16(14)20/h2,5-6,9,12,15H,3-4,7-8,10-11H2,1H3.
What are the key properties of 1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole?
1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole has a molecular weight of 331.44 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentyl-3-methylpyrazol-4-yl)sulfonyl-2,3-dihydroindole is sourced from PubChem (CID 42282733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).