6-(2,5-dichlorophenyl)pyridine-2-carbonitrile

C12H6Cl2N2 — CID 133096229

IUPAC6-(2,5-dichlorophenyl)pyridine-2-carbonitrile
SMILESN#Cc1cccc(-c2cc(Cl)ccc2Cl)n1
InChIInChI=1S/C12H6Cl2N2/c13-8-4-5-11(14)10(6-8)12-3-1-2-9(7-15)16-12/h1-6H
InChIKeyWJUZKUMOAHHRSH-UHFFFAOYSA-N
MW249.10 g/mol
LogP3.93
Rot. Bonds1

About 6-(2,5-dichlorophenyl)pyridine-2-carbonitrile

6-(2,5-dichlorophenyl)pyridine-2-carbonitrile (PubChem CID 133096229) has the molecular formula C12H6Cl2N2 and a molecular weight of 249.10 g/mol. Its IUPAC name is 6-(2,5-dichlorophenyl)pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-(2,5-dichlorophenyl)pyridine-2-carbonitrile
PubChem CID133096229
Molecular FormulaC12H6Cl2N2
Molecular Weight249.10 g/mol
Exact Mass247.99
IUPAC Name6-(2,5-dichlorophenyl)pyridine-2-carbonitrile
SMILESN#Cc1cccc(-c2cc(Cl)ccc2Cl)n1
InChIInChI=1S/C12H6Cl2N2/c13-8-4-5-11(14)10(6-8)12-3-1-2-9(7-15)16-12/h1-6H
InChIKeyWJUZKUMOAHHRSH-UHFFFAOYSA-N
XLogP3.93
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.10
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(2,4,5-trichlorophenyl)pyridine-2-carbonitrile
CID 134630402
6-(2,4,6-trichlorophenyl)pyridine-2-carbonitrile
CID 134636792
6-(4,6-dichloro-3-pyridinyl)pyridine-2-carbonitrile
CID 171482377
5-amino-6-(2,5-dichlorophenyl)pyridine-2-carbonitrile
CID 133096037
2-(2,5-dichlorophenyl)-6-methoxypyridine
CID 118807970
2-[6-(2,5-dichlorophenyl)-3-fluoro-2-pyridinyl]acetonitrile
CID 133094570
2-amino-4-(2,3-dichlorophenyl)-6-(2,5-dichlorophenyl)pyridine-3-carbonitrile
CID 3543956
6-(2-methylphenyl)pyridine-2-carbonitrile
CID 55265377
2-amino-4-(2,4-dichlorophenyl)-6-(2,5-dichlorophenyl)pyridine-3-carbonitrile
CID 3543957
6-(5-chloro-2-fluoroanilino)pyridine-2-carbonitrile
CID 64595678
6-(1H-pyrrol-2-yl)pyridine-2-carbonitrile
CID 91900843
2-(2,5-dichlorophenyl)-1H-benzimidazole-4-carbonitrile
CID 104720410

Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dichlorophenyl)pyridine-2-carbonitrile?
The IUPAC name of 6-(2,5-dichlorophenyl)pyridine-2-carbonitrile (CID 133096229) is 6-(2,5-dichlorophenyl)pyridine-2-carbonitrile.
What is the SMILES notation for 6-(2,5-dichlorophenyl)pyridine-2-carbonitrile?
The canonical SMILES for 6-(2,5-dichlorophenyl)pyridine-2-carbonitrile is N#Cc1cccc(-c2cc(Cl)ccc2Cl)n1.
What is the InChIKey of 6-(2,5-dichlorophenyl)pyridine-2-carbonitrile?
The InChIKey is WJUZKUMOAHHRSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2N2/c13-8-4-5-11(14)10(6-8)12-3-1-2-9(7-15)16-12/h1-6H.
What are the key properties of 6-(2,5-dichlorophenyl)pyridine-2-carbonitrile?
6-(2,5-dichlorophenyl)pyridine-2-carbonitrile has a molecular weight of 249.10 g/mol, XLogP of 3.93, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dichlorophenyl)pyridine-2-carbonitrile is sourced from PubChem (CID 133096229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).