6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile

C9H4Cl2N4 — CID 67042730

IUPAC6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(-n2cnc(Cl)c2Cl)nc1
InChIInChI=1S/C9H4Cl2N4/c10-8-9(11)15(5-14-8)7-2-1-6(3-12)4-13-7/h1-2,4-5H
InChIKeyIKNKFZWUJYSGPC-UHFFFAOYSA-N
MW239.07 g/mol
LogP2.45
Rot. Bonds1

About 6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile

6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile (PubChem CID 67042730) has the molecular formula C9H4Cl2N4 and a molecular weight of 239.07 g/mol. Its IUPAC name is 6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile
PubChem CID67042730
Molecular FormulaC9H4Cl2N4
Molecular Weight239.07 g/mol
Exact Mass237.98
IUPAC Name6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(-n2cnc(Cl)c2Cl)nc1
InChIInChI=1S/C9H4Cl2N4/c10-8-9(11)15(5-14-8)7-2-1-6(3-12)4-13-7/h1-2,4-5H
InChIKeyIKNKFZWUJYSGPC-UHFFFAOYSA-N
XLogP2.45
TPSA54.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.07
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(2-cyanopyrrol-1-yl)pyridine-3-carbonitrile
CID 114650786
6-(4-chloro-3,5-dimethylpyrazol-1-yl)pyridine-3-carbonitrile
CID 62129175
6-(2-methylimidazol-1-yl)pyridine-3-carbonitrile
CID 24701707
6-(2,5-dioxopyrrolidin-1-yl)pyridine-3-carbonitrile
CID 71813200
1-(5-cyano-2-pyridinyl)-1,2,4-triazole-3-carboxylic acid
CID 175302065
6-[4-(3-bromo-5-chloro-2-pyridinyl)piperazin-1-yl]pyridine-3-carbonitrile
CID 167767188
6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile
CID 11849612
6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile
CID 166214209
6-[4-(5-chloro-2-pyridinyl)piperidin-1-yl]pyridine-3-carbonitrile
CID 136574445
6-(2,5-dimethylpiperazin-1-yl)pyridine-3-carbonitrile
CID 64983286
6-(3-propan-2-ylpyrrolidin-1-yl)pyridine-3-carbonitrile
CID 112698394
6-(2,2-dimethylpiperazin-1-yl)pyridine-3-carbonitrile;hydrochloride
CID 67324559

Frequently Asked Questions

What is the IUPAC name of 6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile?
The IUPAC name of 6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile (CID 67042730) is 6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile?
The canonical SMILES for 6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile is N#Cc1ccc(-n2cnc(Cl)c2Cl)nc1.
What is the InChIKey of 6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile?
The InChIKey is IKNKFZWUJYSGPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H4Cl2N4/c10-8-9(11)15(5-14-8)7-2-1-6(3-12)4-13-7/h1-2,4-5H.
What are the key properties of 6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile?
6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile has a molecular weight of 239.07 g/mol, XLogP of 2.45, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,5-dichloroimidazol-1-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 67042730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).