3-bromo-2,6-diphenylpyridine

C17H12BrN — CID 56839636

IUPAC3-bromo-2,6-diphenylpyridine
SMILESBrc1ccc(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C17H12BrN/c18-15-11-12-16(13-7-3-1-4-8-13)19-17(15)14-9-5-2-6-10-14/h1-12H
InChIKeyKYGDXFBBHASUAQ-UHFFFAOYSA-N
MW310.19 g/mol
LogP5.18
Rot. Bonds2

About 3-bromo-2,6-diphenylpyridine

3-bromo-2,6-diphenylpyridine (PubChem CID 56839636) has the molecular formula C17H12BrN and a molecular weight of 310.19 g/mol. Its IUPAC name is 3-bromo-2,6-diphenylpyridine.

Molecular Properties

Compound Name3-bromo-2,6-diphenylpyridine
PubChem CID56839636
Molecular FormulaC17H12BrN
Molecular Weight310.19 g/mol
Exact Mass309.02
IUPAC Name3-bromo-2,6-diphenylpyridine
SMILESBrc1ccc(-c2ccccc2)nc1-c1ccccc1
InChIInChI=1S/C17H12BrN/c18-15-11-12-16(13-7-3-1-4-8-13)19-17(15)14-9-5-2-6-10-14/h1-12H
InChIKeyKYGDXFBBHASUAQ-UHFFFAOYSA-N
XLogP5.18
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.19
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4,23-diphenyl-3,24-diazapentacyclo[18.4.0.02,7.08,13.014,19]tetracosa-1(20),2(7),3,5,8,10,12,14,16,18,21,23-dodecaene
CID 164778968
3-(6-phenyl-2-pyridinyl)-6-[6-(6-phenyl-2-pyridinyl)pyridazin-3-yl]pyridazine
CID 67041293
2-bromo-6-phenyl-3-(4-phenylphenyl)pyridine
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6-(4-fluorophenyl)-2-phenylpyridin-3-ol
CID 132609684
2-phenyl-9-[6-(9-phenyl-1,10-phenanthrolin-2-yl)-2-pyridinyl]-1,10-phenanthroline
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2,3,5-triphenyl-6-[4-(3,5,6-triphenylpyrazin-2-yl)phenyl]pyrazine
CID 139681938
2-bromo-3-methoxy-6-phenylpyridine
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3,5-diphenyl-1H-pyrazolo[4,3-b]pyridine
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2,3-diphenyl-5-(4-phenylphenyl)pyrazine
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3,6-diphenyl-2-pyridin-2-ylpyridine
CID 11652473

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2,6-diphenylpyridine?
The IUPAC name of 3-bromo-2,6-diphenylpyridine (CID 56839636) is 3-bromo-2,6-diphenylpyridine.
What is the SMILES notation for 3-bromo-2,6-diphenylpyridine?
The canonical SMILES for 3-bromo-2,6-diphenylpyridine is Brc1ccc(-c2ccccc2)nc1-c1ccccc1.
What is the InChIKey of 3-bromo-2,6-diphenylpyridine?
The InChIKey is KYGDXFBBHASUAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12BrN/c18-15-11-12-16(13-7-3-1-4-8-13)19-17(15)14-9-5-2-6-10-14/h1-12H.
What are the key properties of 3-bromo-2,6-diphenylpyridine?
3-bromo-2,6-diphenylpyridine has a molecular weight of 310.19 g/mol, XLogP of 5.18, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2,6-diphenylpyridine is sourced from PubChem (CID 56839636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).