3-imidazol-1-ylpyridine

C8H7N3 — CID 4730695

IUPAC3-imidazol-1-ylpyridine
SMILESc1cncc(-n2ccnc2)c1
InChIInChI=1S/C8H7N3/c1-2-8(6-9-3-1)11-5-4-10-7-11/h1-7H
InChIKeyHBSOMQPAIFVKGZ-UHFFFAOYSA-N
MW145.16 g/mol
LogP1.27
Rot. Bonds1

About 3-imidazol-1-ylpyridine

3-imidazol-1-ylpyridine (PubChem CID 4730695) has the molecular formula C8H7N3 and a molecular weight of 145.16 g/mol. Its IUPAC name is 3-imidazol-1-ylpyridine.

Molecular Properties

Compound Name3-imidazol-1-ylpyridine
PubChem CID4730695
Molecular FormulaC8H7N3
Molecular Weight145.16 g/mol
Exact Mass145.06
IUPAC Name3-imidazol-1-ylpyridine
SMILESc1cncc(-n2ccnc2)c1
InChIInChI=1S/C8H7N3/c1-2-8(6-9-3-1)11-5-4-10-7-11/h1-7H
InChIKeyHBSOMQPAIFVKGZ-UHFFFAOYSA-N
XLogP1.27
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-imidazol-1-ylpyridine 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 3-imidazol-1-ylpyridine?
The IUPAC name of 3-imidazol-1-ylpyridine (CID 4730695) is 3-imidazol-1-ylpyridine.
What is the SMILES notation for 3-imidazol-1-ylpyridine?
The canonical SMILES for 3-imidazol-1-ylpyridine is c1cncc(-n2ccnc2)c1.
What is the InChIKey of 3-imidazol-1-ylpyridine?
The InChIKey is HBSOMQPAIFVKGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3/c1-2-8(6-9-3-1)11-5-4-10-7-11/h1-7H.
What are the key properties of 3-imidazol-1-ylpyridine?
3-imidazol-1-ylpyridine has a molecular weight of 145.16 g/mol, XLogP of 1.27, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazol-1-ylpyridine is sourced from PubChem (CID 4730695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).