4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine

C32H26FNO3 — CID 174290369

IUPAC4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine
SMILESCOc1ccccc1-c1cnc(-c2ccccc2OC)c(-c2ccccc2OC)c1-c1ccccc1F
InChIInChI=1S/C32H26FNO3/c1-35-27-17-9-5-12-21(27)25-20-34-32(24-15-7-11-19-29(24)37-3)31(23-14-6-10-18-28(23)36-2)30(25)22-13-4-8-16-26(22)33/h4-20H,1-3H3
InChIKeyONZJRZKQDGBRPM-UHFFFAOYSA-N
MW491.56 g/mol
LogP7.91
Rot. Bonds7

About 4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine

4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine (PubChem CID 174290369) has the molecular formula C32H26FNO3 and a molecular weight of 491.56 g/mol. Its IUPAC name is 4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine.

Molecular Properties

Compound Name4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine
PubChem CID174290369
Molecular FormulaC32H26FNO3
Molecular Weight491.56 g/mol
Exact Mass491.19
IUPAC Name4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine
SMILESCOc1ccccc1-c1cnc(-c2ccccc2OC)c(-c2ccccc2OC)c1-c1ccccc1F
InChIInChI=1S/C32H26FNO3/c1-35-27-17-9-5-12-21(27)25-20-34-32(24-15-7-11-19-29(24)37-3)31(23-14-6-10-18-28(23)36-2)30(25)22-13-4-8-16-26(22)33/h4-20H,1-3H3
InChIKeyONZJRZKQDGBRPM-UHFFFAOYSA-N
XLogP7.91
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500491.56
LogP ≤ 57.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine 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 4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine?
The IUPAC name of 4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine (CID 174290369) is 4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine.
What is the SMILES notation for 4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine?
The canonical SMILES for 4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine is COc1ccccc1-c1cnc(-c2ccccc2OC)c(-c2ccccc2OC)c1-c1ccccc1F.
What is the InChIKey of 4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine?
The InChIKey is ONZJRZKQDGBRPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H26FNO3/c1-35-27-17-9-5-12-21(27)25-20-34-32(24-15-7-11-19-29(24)37-3)31(23-14-6-10-18-28(23)36-2)30(25)22-13-4-8-16-26(22)33/h4-20H,1-3H3.
What are the key properties of 4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine?
4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine has a molecular weight of 491.56 g/mol, XLogP of 7.91, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine is sourced from PubChem (CID 174290369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).