4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine

C17H17F2NO2S — CID 22745664

IUPAC4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine
SMILESCS(=O)(=O)c1c(F)cc(-c2cnccc2C2CCCC2)cc1F
InChIInChI=1S/C17H17F2NO2S/c1-23(21,22)17-15(18)8-12(9-16(17)19)14-10-20-7-6-13(14)11-4-2-3-5-11/h6-11H,2-5H2,1H3
InChIKeyDFRIHKAIPBGDSN-UHFFFAOYSA-N
MW337.39 g/mol
LogP4.09
Rot. Bonds3

About 4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine

4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine (PubChem CID 22745664) has the molecular formula C17H17F2NO2S and a molecular weight of 337.39 g/mol. Its IUPAC name is 4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine.

Molecular Properties

Compound Name4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine
PubChem CID22745664
Molecular FormulaC17H17F2NO2S
Molecular Weight337.39 g/mol
Exact Mass337.09
IUPAC Name4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine
SMILESCS(=O)(=O)c1c(F)cc(-c2cnccc2C2CCCC2)cc1F
InChIInChI=1S/C17H17F2NO2S/c1-23(21,22)17-15(18)8-12(9-16(17)19)14-10-20-7-6-13(14)11-4-2-3-5-11/h6-11H,2-5H2,1H3
InChIKeyDFRIHKAIPBGDSN-UHFFFAOYSA-N
XLogP4.09
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.39
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine 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-(3,5-difluoro-4-methylsulfonylphenyl)-4-pyridin-3-ylpyridine
CID 22745739
2,6-difluoro-4-(4-piperidin-4-yl-3-pyridinyl)phenol
CID 122186017
4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)-2H-furan-5-one
CID 18754719
3-[5-(3,5-difluoro-4-methylsulfonylphenyl)cyclopenta-1,4-dien-1-yl]pyridine
CID 22745487
5-cyclohexyl-2-(difluoromethyl)-4-(3,5-difluoro-4-methylsulfonylphenyl)-1H-imidazole
CID 22746273
1-cyclopentyl-5-(3,5-difluoro-4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole
CID 10200635
4-(3,5-dimethylphenyl)-3-(3-fluoro-4-methylsulfonylphenyl)pyridine
CID 70122138
1,3-difluoro-2-methylsulfonyl-5-phenylbenzene
CID 123960607
2-(4-cyclopentyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole
CID 91570843
4-(4-cyclopentyl-3-sulfanylphenyl)-2,6-difluorobenzenesulfonamide
CID 91058771
3-(3-fluoro-4-methylsulfonylphenyl)-4-(4-methylphenyl)pyridine
CID 70124796
3-(2,5-difluoro-4-methylsulfonylphenyl)-4-(3,5-difluorophenyl)pyridine
CID 22745741

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine?
The IUPAC name of 4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine (CID 22745664) is 4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine.
What is the SMILES notation for 4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine?
The canonical SMILES for 4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine is CS(=O)(=O)c1c(F)cc(-c2cnccc2C2CCCC2)cc1F.
What is the InChIKey of 4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine?
The InChIKey is DFRIHKAIPBGDSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F2NO2S/c1-23(21,22)17-15(18)8-12(9-16(17)19)14-10-20-7-6-13(14)11-4-2-3-5-11/h6-11H,2-5H2,1H3.
What are the key properties of 4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine?
4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine has a molecular weight of 337.39 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-3-(3,5-difluoro-4-methylsulfonylphenyl)pyridine is sourced from PubChem (CID 22745664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).