4-bromo-3-pyridin-2-ylpyridine

C10H7BrN2 — CID 118988962

IUPAC4-bromo-3-pyridin-2-ylpyridine
SMILESBrc1ccncc1-c1ccccn1
InChIInChI=1S/C10H7BrN2/c11-9-4-6-12-7-8(9)10-3-1-2-5-13-10/h1-7H
InChIKeyUTOVWICYHJMUOI-UHFFFAOYSA-N
MW235.08 g/mol
LogP2.91
Rot. Bonds1

About 4-bromo-3-pyridin-2-ylpyridine

4-bromo-3-pyridin-2-ylpyridine (PubChem CID 118988962) has the molecular formula C10H7BrN2 and a molecular weight of 235.08 g/mol. Its IUPAC name is 4-bromo-3-pyridin-2-ylpyridine.

Molecular Properties

Compound Name4-bromo-3-pyridin-2-ylpyridine
PubChem CID118988962
Molecular FormulaC10H7BrN2
Molecular Weight235.08 g/mol
Exact Mass233.98
IUPAC Name4-bromo-3-pyridin-2-ylpyridine
SMILESBrc1ccncc1-c1ccccn1
InChIInChI=1S/C10H7BrN2/c11-9-4-6-12-7-8(9)10-3-1-2-5-13-10/h1-7H
InChIKeyUTOVWICYHJMUOI-UHFFFAOYSA-N
XLogP2.91
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.08
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;4-methyl-3-pyridin-2-ylpyridine
CID 143216291
trimethyl-(3-pyridin-2-yl-4-pyridinyl)silane
CID 139787163
2-(2-pyridin-2-ylphenyl)pyrazine
CID 91494990
4-chloro-5-pyridin-2-ylpyrimidine
CID 105371145
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847
4-bromopyridine;2,6-dipyridin-2-ylpyridine
CID 70125485

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-pyridin-2-ylpyridine?
The IUPAC name of 4-bromo-3-pyridin-2-ylpyridine (CID 118988962) is 4-bromo-3-pyridin-2-ylpyridine.
What is the SMILES notation for 4-bromo-3-pyridin-2-ylpyridine?
The canonical SMILES for 4-bromo-3-pyridin-2-ylpyridine is Brc1ccncc1-c1ccccn1.
What is the InChIKey of 4-bromo-3-pyridin-2-ylpyridine?
The InChIKey is UTOVWICYHJMUOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrN2/c11-9-4-6-12-7-8(9)10-3-1-2-5-13-10/h1-7H.
What are the key properties of 4-bromo-3-pyridin-2-ylpyridine?
4-bromo-3-pyridin-2-ylpyridine has a molecular weight of 235.08 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3-pyridin-2-ylpyridine is sourced from PubChem (CID 118988962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).