2-bromopyridine

C5H4BrN — CID 7973

IUPAC2-bromopyridine
SMILESBrc1ccccn1
InChIInChI=1S/C5H4BrN/c6-5-3-1-2-4-7-5/h1-4H
InChIKeyIMRWILPUOVGIMU-UHFFFAOYSA-N
MW158.00 g/mol
LogP1.84
Rot. Bonds

About 2-bromopyridine

2-bromopyridine (PubChem CID 7973) has the molecular formula C5H4BrN and a molecular weight of 158.00 g/mol. Its IUPAC name is 2-bromopyridine.

Molecular Properties

Compound Name2-bromopyridine
PubChem CID7973
Molecular FormulaC5H4BrN
Molecular Weight158.00 g/mol
Exact Mass156.95
IUPAC Name2-bromopyridine
SMILESBrc1ccccn1
InChIInChI=1S/C5H4BrN/c6-5-3-1-2-4-7-5/h1-4H
InChIKeyIMRWILPUOVGIMU-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

Pyridine
CID 1049
3-Methylpyridine
CID 7970
4-Methylpyridine
CID 7963
4-Vinylpyridine
CID 7502
2-Methylpyridine
CID 7975
2-Vinylpyridine
CID 7521
Pyridine N-Oxide
CID 12753
3-Vinylpyridine
CID 14272
Pyridine-D5
CID 558519
2-Amino-5-bromopyridine
CID 70622
3-Bromopyridine
CID 12286
Pyridinium chloride
CID 10176127

Frequently Asked Questions

What is the IUPAC name of 2-bromopyridine?
The IUPAC name of 2-bromopyridine (CID 7973) is 2-bromopyridine.
What is the SMILES notation for 2-bromopyridine?
The canonical SMILES for 2-bromopyridine is Brc1ccccn1.
What is the InChIKey of 2-bromopyridine?
The InChIKey is IMRWILPUOVGIMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4BrN/c6-5-3-1-2-4-7-5/h1-4H.
What are the key properties of 2-bromopyridine?
2-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 2-bromopyridine is sourced from PubChem (CID 7973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).