4-(2,6-dichlorophenyl)-2,6-diphenylpyridine

C23H15Cl2N — CID 139203314

IUPAC4-(2,6-dichlorophenyl)-2,6-diphenylpyridine
SMILESClc1cccc(Cl)c1-c1cc(-c2ccccc2)nc(-c2ccccc2)c1
InChIInChI=1S/C23H15Cl2N/c24-19-12-7-13-20(25)23(19)18-14-21(16-8-3-1-4-9-16)26-22(15-18)17-10-5-2-6-11-17/h1-15H
InChIKeyPGVNNNNGCPHWGV-UHFFFAOYSA-N
MW376.29 g/mol
LogP7.39
Rot. Bonds3

About 4-(2,6-dichlorophenyl)-2,6-diphenylpyridine

4-(2,6-dichlorophenyl)-2,6-diphenylpyridine (PubChem CID 139203314) has the molecular formula C23H15Cl2N and a molecular weight of 376.29 g/mol. Its IUPAC name is 4-(2,6-dichlorophenyl)-2,6-diphenylpyridine.

Molecular Properties

Compound Name4-(2,6-dichlorophenyl)-2,6-diphenylpyridine
PubChem CID139203314
Molecular FormulaC23H15Cl2N
Molecular Weight376.29 g/mol
Exact Mass375.06
IUPAC Name4-(2,6-dichlorophenyl)-2,6-diphenylpyridine
SMILESClc1cccc(Cl)c1-c1cc(-c2ccccc2)nc(-c2ccccc2)c1
InChIInChI=1S/C23H15Cl2N/c24-19-12-7-13-20(25)23(19)18-14-21(16-8-3-1-4-9-16)26-22(15-18)17-10-5-2-6-11-17/h1-15H
InChIKeyPGVNNNNGCPHWGV-UHFFFAOYSA-N
XLogP7.39
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.29
LogP ≤ 57.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dichlorophenyl)-2,6-diphenylpyridine?
The IUPAC name of 4-(2,6-dichlorophenyl)-2,6-diphenylpyridine (CID 139203314) is 4-(2,6-dichlorophenyl)-2,6-diphenylpyridine.
What is the SMILES notation for 4-(2,6-dichlorophenyl)-2,6-diphenylpyridine?
The canonical SMILES for 4-(2,6-dichlorophenyl)-2,6-diphenylpyridine is Clc1cccc(Cl)c1-c1cc(-c2ccccc2)nc(-c2ccccc2)c1.
What is the InChIKey of 4-(2,6-dichlorophenyl)-2,6-diphenylpyridine?
The InChIKey is PGVNNNNGCPHWGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15Cl2N/c24-19-12-7-13-20(25)23(19)18-14-21(16-8-3-1-4-9-16)26-22(15-18)17-10-5-2-6-11-17/h1-15H.
What are the key properties of 4-(2,6-dichlorophenyl)-2,6-diphenylpyridine?
4-(2,6-dichlorophenyl)-2,6-diphenylpyridine has a molecular weight of 376.29 g/mol, XLogP of 7.39, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dichlorophenyl)-2,6-diphenylpyridine is sourced from PubChem (CID 139203314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).