2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine

C22H14F2N2 — CID 139291631

IUPAC2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine
SMILESFc1ccc(-c2cc(-c3ccncc3)cc(-c3ccc(F)cc3)n2)cc1
InChIInChI=1S/C22H14F2N2/c23-19-5-1-16(2-6-19)21-13-18(15-9-11-25-12-10-15)14-22(26-21)17-3-7-20(24)8-4-17/h1-14H
InChIKeyOSSXZJCVDCAWCP-UHFFFAOYSA-N
MW344.36 g/mol
LogP5.76
Rot. Bonds3

About 2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine

2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine (PubChem CID 139291631) has the molecular formula C22H14F2N2 and a molecular weight of 344.36 g/mol. Its IUPAC name is 2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine.

Molecular Properties

Compound Name2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine
PubChem CID139291631
Molecular FormulaC22H14F2N2
Molecular Weight344.36 g/mol
Exact Mass344.11
IUPAC Name2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine
SMILESFc1ccc(-c2cc(-c3ccncc3)cc(-c3ccc(F)cc3)n2)cc1
InChIInChI=1S/C22H14F2N2/c23-19-5-1-16(2-6-19)21-13-18(15-9-11-25-12-10-15)14-22(26-21)17-3-7-20(24)8-4-17/h1-14H
InChIKeyOSSXZJCVDCAWCP-UHFFFAOYSA-N
XLogP5.76
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.36
LogP ≤ 55.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(+-)-Dimethindene
CID 21855
Pheniramine
CID 4761
Azatadine
CID 19861
5,5'-Dimethyl-2,2'-bipyridyl
CID 15664
Anabaseine
CID 18985
4-Phenylpyridine
CID 13651
2-(3-Phenylpropyl)Pyridine
CID 459494
4,4'-Bipyridine
CID 11107
3-Phenylpyridine
CID 13886
4,4'-Dimethyl-2,2'-bipyridine
CID 14338
2,3'-Bipyridine
CID 11389
Lanicemine
CID 9794203

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine?
The IUPAC name of 2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine (CID 139291631) is 2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine.
What is the SMILES notation for 2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine?
The canonical SMILES for 2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine is Fc1ccc(-c2cc(-c3ccncc3)cc(-c3ccc(F)cc3)n2)cc1.
What is the InChIKey of 2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine?
The InChIKey is OSSXZJCVDCAWCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14F2N2/c23-19-5-1-16(2-6-19)21-13-18(15-9-11-25-12-10-15)14-22(26-21)17-3-7-20(24)8-4-17/h1-14H.
What are the key properties of 2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine?
2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine has a molecular weight of 344.36 g/mol, XLogP of 5.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(4-fluorophenyl)-4-pyridin-4-ylpyridine is sourced from PubChem (CID 139291631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).