pyridine-2-carbonitrile

C6H4N2 — CID 7522

IUPACpyridine-2-carbonitrile
SMILESN#Cc1ccccn1
InChIInChI=1S/C6H4N2/c7-5-6-3-1-2-4-8-6/h1-4H
InChIKeyFFNVQNRYTPFDDP-UHFFFAOYSA-N
MW104.11 g/mol
LogP0.95
Rot. Bonds

About pyridine-2-carbonitrile

pyridine-2-carbonitrile (PubChem CID 7522) has the molecular formula C6H4N2 and a molecular weight of 104.11 g/mol. Its IUPAC name is pyridine-2-carbonitrile.

Molecular Properties

Compound Namepyridine-2-carbonitrile
PubChem CID7522
Molecular FormulaC6H4N2
Molecular Weight104.11 g/mol
Exact Mass104.04
IUPAC Namepyridine-2-carbonitrile
SMILESN#Cc1ccccn1
InChIInChI=1S/C6H4N2/c7-5-6-3-1-2-4-8-6/h1-4H
InChIKeyFFNVQNRYTPFDDP-UHFFFAOYSA-N
XLogP0.95
TPSA36.68 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.11
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze pyridine-2-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

Pyridine
CID 1049
4-Aminopyridine
CID 1727
2,2'-Bipyridine
CID 1474
Pralidoxime Chloride
CID 135445761
2-Methylpyridine
CID 7975
2-Vinylpyridine
CID 7521
Betahistine
CID 2366
2-Pyridineethanamine
CID 75919
3-Cyanopyridine
CID 79
5-Ethyl-2-methylpyridine
CID 7728
Pralidoxime
CID 135398747
2,4-Dimethylpyridine
CID 7936

Frequently Asked Questions

What is the IUPAC name of pyridine-2-carbonitrile?
The IUPAC name of pyridine-2-carbonitrile (CID 7522) is pyridine-2-carbonitrile.
What is the SMILES notation for pyridine-2-carbonitrile?
The canonical SMILES for pyridine-2-carbonitrile is N#Cc1ccccn1.
What is the InChIKey of pyridine-2-carbonitrile?
The InChIKey is FFNVQNRYTPFDDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N2/c7-5-6-3-1-2-4-8-6/h1-4H.
What are the key properties of pyridine-2-carbonitrile?
pyridine-2-carbonitrile has a molecular weight of 104.11 g/mol, XLogP of 0.95, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyridine-2-carbonitrile is sourced from PubChem (CID 7522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).