2-(azetidin-3-yl)pyridine-3-carbonitrile

C9H9N3 — CID 67323023

IUPAC2-(azetidin-3-yl)pyridine-3-carbonitrile
SMILESN#Cc1cccnc1C1CNC1
InChIInChI=1S/C9H9N3/c10-4-7-2-1-3-12-9(7)8-5-11-6-8/h1-3,8,11H,5-6H2
InChIKeyFGLNFHLGMLOASK-UHFFFAOYSA-N
MW159.19 g/mol
LogP0.64
Rot. Bonds1

About 2-(azetidin-3-yl)pyridine-3-carbonitrile

2-(azetidin-3-yl)pyridine-3-carbonitrile (PubChem CID 67323023) has the molecular formula C9H9N3 and a molecular weight of 159.19 g/mol. Its IUPAC name is 2-(azetidin-3-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(azetidin-3-yl)pyridine-3-carbonitrile
PubChem CID67323023
Molecular FormulaC9H9N3
Molecular Weight159.19 g/mol
Exact Mass159.08
IUPAC Name2-(azetidin-3-yl)pyridine-3-carbonitrile
SMILESN#Cc1cccnc1C1CNC1
InChIInChI=1S/C9H9N3/c10-4-7-2-1-3-12-9(7)8-5-11-6-8/h1-3,8,11H,5-6H2
InChIKeyFGLNFHLGMLOASK-UHFFFAOYSA-N
XLogP0.64
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(azetidin-3-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

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)pyridine-3-carbonitrile?
The IUPAC name of 2-(azetidin-3-yl)pyridine-3-carbonitrile (CID 67323023) is 2-(azetidin-3-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-(azetidin-3-yl)pyridine-3-carbonitrile?
The canonical SMILES for 2-(azetidin-3-yl)pyridine-3-carbonitrile is N#Cc1cccnc1C1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)pyridine-3-carbonitrile?
The InChIKey is FGLNFHLGMLOASK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3/c10-4-7-2-1-3-12-9(7)8-5-11-6-8/h1-3,8,11H,5-6H2.
What are the key properties of 2-(azetidin-3-yl)pyridine-3-carbonitrile?
2-(azetidin-3-yl)pyridine-3-carbonitrile has a molecular weight of 159.19 g/mol, XLogP of 0.64, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 67323023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).