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

C22H14Cl2N2 — CID 139291640

IUPAC2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine
SMILESClc1ccccc1-c1cc(-c2ccncc2)cc(-c2ccccc2Cl)n1
InChIInChI=1S/C22H14Cl2N2/c23-19-7-3-1-5-17(19)21-13-16(15-9-11-25-12-10-15)14-22(26-21)18-6-2-4-8-20(18)24/h1-14H
InChIKeyLPGWSSZMCJDUTR-UHFFFAOYSA-N
MW377.27 g/mol
LogP6.78
Rot. Bonds3

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

2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine (PubChem CID 139291640) has the molecular formula C22H14Cl2N2 and a molecular weight of 377.27 g/mol. Its IUPAC name is 2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine.

Molecular Properties

Compound Name2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine
PubChem CID139291640
Molecular FormulaC22H14Cl2N2
Molecular Weight377.27 g/mol
Exact Mass376.05
IUPAC Name2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine
SMILESClc1ccccc1-c1cc(-c2ccncc2)cc(-c2ccccc2Cl)n1
InChIInChI=1S/C22H14Cl2N2/c23-19-7-3-1-5-17(19)21-13-16(15-9-11-25-12-10-15)14-22(26-21)18-6-2-4-8-20(18)24/h1-14H
InChIKeyLPGWSSZMCJDUTR-UHFFFAOYSA-N
XLogP6.78
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.27
LogP ≤ 56.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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13-Chloro-2-(1-ethylpiperidin-4-ylidene)-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaene
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2-(4'-Chlorobenzyl)pyridine
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Frequently Asked Questions

What is the IUPAC name of 2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine?
The IUPAC name of 2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine (CID 139291640) is 2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine.
What is the SMILES notation for 2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine?
The canonical SMILES for 2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine is Clc1ccccc1-c1cc(-c2ccncc2)cc(-c2ccccc2Cl)n1.
What is the InChIKey of 2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine?
The InChIKey is LPGWSSZMCJDUTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14Cl2N2/c23-19-7-3-1-5-17(19)21-13-16(15-9-11-25-12-10-15)14-22(26-21)18-6-2-4-8-20(18)24/h1-14H.
What are the key properties of 2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine?
2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine has a molecular weight of 377.27 g/mol, XLogP of 6.78, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(2-chlorophenyl)-4-pyridin-4-ylpyridine is sourced from PubChem (CID 139291640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).