5-bromo-2-(4-fluoro-3-methylphenyl)pyridine

C12H9BrFN — CID 83920260

IUPAC5-bromo-2-(4-fluoro-3-methylphenyl)pyridine
SMILESCc1cc(-c2ccc(Br)cn2)ccc1F
InChIInChI=1S/C12H9BrFN/c1-8-6-9(2-4-11(8)14)12-5-3-10(13)7-15-12/h2-7H,1H3
InChIKeyOVDONMIWXIZPCY-UHFFFAOYSA-N
MW266.11 g/mol
LogP3.96
Rot. Bonds1

About 5-bromo-2-(4-fluoro-3-methylphenyl)pyridine

5-bromo-2-(4-fluoro-3-methylphenyl)pyridine (PubChem CID 83920260) has the molecular formula C12H9BrFN and a molecular weight of 266.11 g/mol. Its IUPAC name is 5-bromo-2-(4-fluoro-3-methylphenyl)pyridine.

Molecular Properties

Compound Name5-bromo-2-(4-fluoro-3-methylphenyl)pyridine
PubChem CID83920260
Molecular FormulaC12H9BrFN
Molecular Weight266.11 g/mol
Exact Mass264.99
IUPAC Name5-bromo-2-(4-fluoro-3-methylphenyl)pyridine
SMILESCc1cc(-c2ccc(Br)cn2)ccc1F
InChIInChI=1S/C12H9BrFN/c1-8-6-9(2-4-11(8)14)12-5-3-10(13)7-15-12/h2-7H,1H3
InChIKeyOVDONMIWXIZPCY-UHFFFAOYSA-N
XLogP3.96
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.11
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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3-bromo-5-(4-fluoro-3-methylphenyl)phenol
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5-(1,2-dihydroimidazol-3-ylmethyl)-2-(4-fluoro-3-methylphenyl)pyridine
CID 172708874
5-bromo-2-(4-phenylphenyl)pyridine
CID 59156304
3-(4-fluoro-3-methylphenyl)-1-propan-2-ylpyrazole
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4-(4-fluoro-3-methylphenyl)-1H-pyrazole
CID 118018809
4-bromo-1-fluoro-2-methylbenzene;4-bromo-2-fluoro-1-methylbenzene
CID 160825147
2-(3-fluoro-4-methylphenyl)-5-(trifluoromethyl)pyridine
CID 70985275
6-(4-fluoro-3-methylphenyl)pyridazine-3-carbaldehyde
CID 82284842
5-bromo-2-(4-ethoxyphenyl)pyridine
CID 83920618
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CID 79556620

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(4-fluoro-3-methylphenyl)pyridine?
The IUPAC name of 5-bromo-2-(4-fluoro-3-methylphenyl)pyridine (CID 83920260) is 5-bromo-2-(4-fluoro-3-methylphenyl)pyridine.
What is the SMILES notation for 5-bromo-2-(4-fluoro-3-methylphenyl)pyridine?
The canonical SMILES for 5-bromo-2-(4-fluoro-3-methylphenyl)pyridine is Cc1cc(-c2ccc(Br)cn2)ccc1F.
What is the InChIKey of 5-bromo-2-(4-fluoro-3-methylphenyl)pyridine?
The InChIKey is OVDONMIWXIZPCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrFN/c1-8-6-9(2-4-11(8)14)12-5-3-10(13)7-15-12/h2-7H,1H3.
What are the key properties of 5-bromo-2-(4-fluoro-3-methylphenyl)pyridine?
5-bromo-2-(4-fluoro-3-methylphenyl)pyridine has a molecular weight of 266.11 g/mol, XLogP of 3.96, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(4-fluoro-3-methylphenyl)pyridine is sourced from PubChem (CID 83920260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).