2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine

C17H19FN2O2S — CID 95817962

IUPAC2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine
SMILESCS(=O)(=O)N1CCC[C@@H](c2cccc(-c3ccc(F)cc3)n2)C1
InChIInChI=1S/C17H19FN2O2S/c1-23(21,22)20-11-3-4-14(12-20)17-6-2-5-16(19-17)13-7-9-15(18)10-8-13/h2,5-10,14H,3-4,11-12H2,1H3/t14-/m1/s1
InChIKeyYDTYSBFGLXNPMA-CQSZACIVSA-N
MW334.42 g/mol
LogP3.03
Rot. Bonds3

About 2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine

2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine (PubChem CID 95817962) has the molecular formula C17H19FN2O2S and a molecular weight of 334.42 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine
PubChem CID95817962
Molecular FormulaC17H19FN2O2S
Molecular Weight334.42 g/mol
Exact Mass334.12
IUPAC Name2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine
SMILESCS(=O)(=O)N1CCC[C@@H](c2cccc(-c3ccc(F)cc3)n2)C1
InChIInChI=1S/C17H19FN2O2S/c1-23(21,22)20-11-3-4-14(12-20)17-6-2-5-16(19-17)13-7-9-15(18)10-8-13/h2,5-10,14H,3-4,11-12H2,1H3/t14-/m1/s1
InChIKeyYDTYSBFGLXNPMA-CQSZACIVSA-N
XLogP3.03
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]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

2-(3-fluorophenyl)-6-(1-methylsulfonylpiperidin-3-yl)pyridine
CID 110249421
(3R)-3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-1-methylsulfonylpiperidine
CID 95107377
2-(2-methylpyrazol-3-yl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine
CID 124967187
(4-fluorophenyl)-[3-[6-(4-fluorophenyl)-2-pyridinyl]piperidin-1-yl]methanone
CID 110249296
1-[(3S)-3-[6-(4-fluorophenyl)-2-pyridinyl]piperidin-1-yl]-2-methoxyethanone
CID 95809586
N-cyclopentyl-6-(1-methylsulfonylpiperidin-3-yl)pyridin-2-amine
CID 110257261
2-(2-ethylpyrazol-3-yl)-6-[(3S)-1-methylsulfonylpiperidin-3-yl]pyridine
CID 124988141
2-(dimethylamino)-1-[(3S)-3-[6-(4-fluorophenyl)-2-pyridinyl]piperidin-1-yl]ethanone
CID 124946413
4-[6-(1-methylsulfonylpiperidin-3-yl)pyrazin-2-yl]benzoic acid
CID 110112232
2-[(3S)-1-methylsulfonylpiperidin-3-yl]-6-(2-propylpyrazol-3-yl)pyridine
CID 124943820
3-[6-[(3S)-1-(4-fluorophenyl)sulfonylpiperidin-3-yl]-2-pyridinyl]benzamide
CID 95809420
[3-(dimethylamino)phenyl]-[3-[6-(4-fluorophenyl)-2-pyridinyl]piperidin-1-yl]methanone
CID 110255959

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine?
The IUPAC name of 2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine (CID 95817962) is 2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine.
What is the SMILES notation for 2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine?
The canonical SMILES for 2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine is CS(=O)(=O)N1CCC[C@@H](c2cccc(-c3ccc(F)cc3)n2)C1.
What is the InChIKey of 2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine?
The InChIKey is YDTYSBFGLXNPMA-CQSZACIVSA-N. The full InChI is InChI=1S/C17H19FN2O2S/c1-23(21,22)20-11-3-4-14(12-20)17-6-2-5-16(19-17)13-7-9-15(18)10-8-13/h2,5-10,14H,3-4,11-12H2,1H3/t14-/m1/s1.
What are the key properties of 2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine?
2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine has a molecular weight of 334.42 g/mol, XLogP of 3.03, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-6-[(3R)-1-methylsulfonylpiperidin-3-yl]pyridine is sourced from PubChem (CID 95817962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).