bromonickel;2-phenyl-6-pyridin-2-ylpyridine

C16H11BrN2Ni- — CID 153499013

IUPACbromonickel;2-phenyl-6-pyridin-2-ylpyridine
SMILES[Ni]Br.[c-]1ccccc1-c1cccc(-c2ccccn2)n1
InChIInChI=1S/C16H11N2.BrH.Ni/c1-2-7-13(8-3-1)14-10-6-11-16(18-14)15-9-4-5-12-17-15;;/h1-7,9-12H;1H;/q-1;;+1/p-1
InChIKeyILUQJMBHFDUTDI-UHFFFAOYSA-M
MW369.88 g/mol
LogP4.45
Rot. Bonds2

About bromonickel;2-phenyl-6-pyridin-2-ylpyridine

bromonickel;2-phenyl-6-pyridin-2-ylpyridine (PubChem CID 153499013) has the molecular formula C16H11BrN2Ni- and a molecular weight of 369.88 g/mol. Its IUPAC name is bromonickel;2-phenyl-6-pyridin-2-ylpyridine.

Molecular Properties

Compound Namebromonickel;2-phenyl-6-pyridin-2-ylpyridine
PubChem CID153499013
Molecular FormulaC16H11BrN2Ni-
Molecular Weight369.88 g/mol
Exact Mass367.95
IUPAC Namebromonickel;2-phenyl-6-pyridin-2-ylpyridine
SMILES[Ni]Br.[c-]1ccccc1-c1cccc(-c2ccccn2)n1
InChIInChI=1S/C16H11N2.BrH.Ni/c1-2-7-13(8-3-1)14-10-6-11-16(18-14)15-9-4-5-12-17-15;;/h1-7,9-12H;1H;/q-1;;+1/p-1
InChIKeyILUQJMBHFDUTDI-UHFFFAOYSA-M
XLogP4.45
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.88
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

chlororuthenium(2+);2,6-dipyridin-2-ylpyridine;2-phenylpyridine;hexafluorophosphate
CID 50901693
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iridium;tris(2-phenylpyridine)
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bis(chloroiridium(2+));tetrakis(2-phenylpyridine)
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chlorozinc(1+);2-phenylpyridine
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2-phenylpyridine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);hexafluorophosphate
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1,9-dihydrodibenzofuran-1,9-diide;2-phenyl-6-pyridin-2-ylpyridine;bis(platinum(2+));2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine
CID 164733625
dichloroiridium(1+);tetrakis(2-phenylpyridine)
CID 175874187
formic acid;bis(iridium);bis(2-phenylpyridine)
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nickel;2-[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]phenol
CID 153499066
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chloroplatinum(1+);2-phenylpyridine;2-phenylpyridine
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Frequently Asked Questions

What is the IUPAC name of bromonickel;2-phenyl-6-pyridin-2-ylpyridine?
The IUPAC name of bromonickel;2-phenyl-6-pyridin-2-ylpyridine (CID 153499013) is bromonickel;2-phenyl-6-pyridin-2-ylpyridine.
What is the SMILES notation for bromonickel;2-phenyl-6-pyridin-2-ylpyridine?
The canonical SMILES for bromonickel;2-phenyl-6-pyridin-2-ylpyridine is [Ni]Br.[c-]1ccccc1-c1cccc(-c2ccccn2)n1.
What is the InChIKey of bromonickel;2-phenyl-6-pyridin-2-ylpyridine?
The InChIKey is ILUQJMBHFDUTDI-UHFFFAOYSA-M. The full InChI is InChI=1S/C16H11N2.BrH.Ni/c1-2-7-13(8-3-1)14-10-6-11-16(18-14)15-9-4-5-12-17-15;;/h1-7,9-12H;1H;/q-1;;+1/p-1.
What are the key properties of bromonickel;2-phenyl-6-pyridin-2-ylpyridine?
bromonickel;2-phenyl-6-pyridin-2-ylpyridine has a molecular weight of 369.88 g/mol, XLogP of 4.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bromonickel;2-phenyl-6-pyridin-2-ylpyridine is sourced from PubChem (CID 153499013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).