4-bromopyridine

C5H4BrN — CID 14268

IUPAC4-bromopyridine
SMILESBrc1ccncc1
InChIInChI=1S/C5H4BrN/c6-5-1-3-7-4-2-5/h1-4H
InChIKeyBSDGZUDFPKIYQG-UHFFFAOYSA-N
MW158.00 g/mol
LogP1.84
Rot. Bonds

About 4-bromopyridine

4-bromopyridine (PubChem CID 14268) has the molecular formula C5H4BrN and a molecular weight of 158.00 g/mol. Its IUPAC name is 4-bromopyridine.

Molecular Properties

Compound Name4-bromopyridine
PubChem CID14268
Molecular FormulaC5H4BrN
Molecular Weight158.00 g/mol
Exact Mass156.95
IUPAC Name4-bromopyridine
SMILESBrc1ccncc1
InChIInChI=1S/C5H4BrN/c6-5-1-3-7-4-2-5/h1-4H
InChIKeyBSDGZUDFPKIYQG-UHFFFAOYSA-N
XLogP1.84
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.00
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-bromopyridine 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 4-bromopyridine?
The IUPAC name of 4-bromopyridine (CID 14268) is 4-bromopyridine.
What is the SMILES notation for 4-bromopyridine?
The canonical SMILES for 4-bromopyridine is Brc1ccncc1.
What is the InChIKey of 4-bromopyridine?
The InChIKey is BSDGZUDFPKIYQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4BrN/c6-5-1-3-7-4-2-5/h1-4H.
What are the key properties of 4-bromopyridine?
4-bromopyridine has a molecular weight of 158.00 g/mol, XLogP of 1.84, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromopyridine is sourced from PubChem (CID 14268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).