6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile

C18H10N4 — CID 11849612

IUPAC6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile
SMILESN#Cc1ccc(-c2ccc(-c3ccc(C#N)cn3)cc2)nc1
InChIInChI=1S/C18H10N4/c19-9-13-1-7-17(21-11-13)15-3-5-16(6-4-15)18-8-2-14(10-20)12-22-18/h1-8,11-12H
InChIKeyPZLDAKOMMSUFQS-UHFFFAOYSA-N
MW282.31 g/mol
LogP3.55
Rot. Bonds2

About 6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile

6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile (PubChem CID 11849612) has the molecular formula C18H10N4 and a molecular weight of 282.31 g/mol. Its IUPAC name is 6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile
PubChem CID11849612
Molecular FormulaC18H10N4
Molecular Weight282.31 g/mol
Exact Mass282.09
IUPAC Name6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile
SMILESN#Cc1ccc(-c2ccc(-c3ccc(C#N)cn3)cc2)nc1
InChIInChI=1S/C18H10N4/c19-9-13-1-7-17(21-11-13)15-3-5-16(6-4-15)18-8-2-14(10-20)12-22-18/h1-8,11-12H
InChIKeyPZLDAKOMMSUFQS-UHFFFAOYSA-N
XLogP3.55
TPSA73.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.31
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-[4-(5-cyano-2-pyridinyl)phenyl]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

Frequently Asked Questions

What is the IUPAC name of 6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile?
The IUPAC name of 6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile (CID 11849612) is 6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile?
The canonical SMILES for 6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile is N#Cc1ccc(-c2ccc(-c3ccc(C#N)cn3)cc2)nc1.
What is the InChIKey of 6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile?
The InChIKey is PZLDAKOMMSUFQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10N4/c19-9-13-1-7-17(21-11-13)15-3-5-16(6-4-15)18-8-2-14(10-20)12-22-18/h1-8,11-12H.
What are the key properties of 6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile?
6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile has a molecular weight of 282.31 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile is sourced from PubChem (CID 11849612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).