5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine

C19H15F2NO2S — CID 21099514

IUPAC5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine
SMILESO=S(=O)(c1ccc(F)cc1)c1ccc(CCc2ccc(F)cc2)cn1
InChIInChI=1S/C19H15F2NO2S/c20-16-6-3-14(4-7-16)1-2-15-5-12-19(22-13-15)25(23,24)18-10-8-17(21)9-11-18/h3-13H,1-2H2
InChIKeyPABZJFZRAJANGX-UHFFFAOYSA-N
MW359.40 g/mol
LogP3.98
Rot. Bonds5

About 5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine

5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine (PubChem CID 21099514) has the molecular formula C19H15F2NO2S and a molecular weight of 359.40 g/mol. Its IUPAC name is 5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine.

Molecular Properties

Compound Name5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine
PubChem CID21099514
Molecular FormulaC19H15F2NO2S
Molecular Weight359.40 g/mol
Exact Mass359.08
IUPAC Name5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine
SMILESO=S(=O)(c1ccc(F)cc1)c1ccc(CCc2ccc(F)cc2)cn1
InChIInChI=1S/C19H15F2NO2S/c20-16-6-3-14(4-7-16)1-2-15-5-12-19(22-13-15)25(23,24)18-10-8-17(21)9-11-18/h3-13H,1-2H2
InChIKeyPABZJFZRAJANGX-UHFFFAOYSA-N
XLogP3.98
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.40
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine?
The IUPAC name of 5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine (CID 21099514) is 5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine.
What is the SMILES notation for 5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine?
The canonical SMILES for 5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine is O=S(=O)(c1ccc(F)cc1)c1ccc(CCc2ccc(F)cc2)cn1.
What is the InChIKey of 5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine?
The InChIKey is PABZJFZRAJANGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2NO2S/c20-16-6-3-14(4-7-16)1-2-15-5-12-19(22-13-15)25(23,24)18-10-8-17(21)9-11-18/h3-13H,1-2H2.
What are the key properties of 5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine?
5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine has a molecular weight of 359.40 g/mol, XLogP of 3.98, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-fluorophenyl)ethyl]-2-(4-fluorophenyl)sulfonylpyridine is sourced from PubChem (CID 21099514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).