2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide

C23H16N4Pt — CID 20807166

IUPAC2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide
SMILES[Pt+2].[c-]1ccccc1-c1ccccn1.c1ccc(-c2nc3ccccc3[n-]2)nc1
InChIInChI=1S/C12H8N3.C11H8N.Pt/c1-2-6-10-9(5-1)14-12(15-10)11-7-3-4-8-13-11;1-2-6-10(7-3-1)11-8-4-5-9-12-11;/h1-8H;1-6,8-9H;/q2*-1;+2
InChIKeyRLONGTVSYZTIPN-UHFFFAOYSA-N
MW543.49 g/mol
LogP4.80
Rot. Bonds2

About 2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide

2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide (PubChem CID 20807166) has the molecular formula C23H16N4Pt and a molecular weight of 543.49 g/mol. Its IUPAC name is 2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide.

Molecular Properties

Compound Name2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide
PubChem CID20807166
Molecular FormulaC23H16N4Pt
Molecular Weight543.49 g/mol
Exact Mass543.10
IUPAC Name2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide
SMILES[Pt+2].[c-]1ccccc1-c1ccccn1.c1ccc(-c2nc3ccccc3[n-]2)nc1
InChIInChI=1S/C12H8N3.C11H8N.Pt/c1-2-6-10-9(5-1)14-12(15-10)11-7-3-4-8-13-11;1-2-6-10(7-3-1)11-8-4-5-9-12-11;/h1-8H;1-6,8-9H;/q2*-1;+2
InChIKeyRLONGTVSYZTIPN-UHFFFAOYSA-N
XLogP4.80
TPSA52.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500543.49
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

iridium(3+);bis(2-phenylpyridine);2-pyridin-2-ylbenzimidazol-1-ide
CID 59010560
iridium;tris(2-phenylpyridine)
CID 23386734
bis(chloroiridium(2+));tetrakis(2-phenylpyridine)
CID 54724512
bis(2-phenylpyridine);bis(platinum(2+));bis(pyrido[2,3-b]indol-9-ide)
CID 176621886
chlorozinc(1+);2-phenylpyridine
CID 59773311
dichloroiridium(1+);tetrakis(2-phenylpyridine)
CID 175874187
bis(2-phenylpyridine);bis(2-phenylpyrido[2,3-b]indol-9-ide);bis(platinum(2+))
CID 176622002
iridium;2-phenylpyridine;2-pyridin-2-yl-1,3-benzothiazole
CID 58281788
2-phenylpyridine;bis(2-pyridin-2-ylpyridine);ruthenium(2+);hexafluorophosphate
CID 10963599
formic acid;bis(iridium);bis(2-phenylpyridine)
CID 58163235
bromonickel;2-phenyl-6-pyridin-2-ylpyridine
CID 153499013
chloroplatinum(1+);2-phenylpyridine;2-phenylpyridine
CID 54698144

Frequently Asked Questions

What is the IUPAC name of 2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide?
The IUPAC name of 2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide (CID 20807166) is 2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide.
What is the SMILES notation for 2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide?
The canonical SMILES for 2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide is [Pt+2].[c-]1ccccc1-c1ccccn1.c1ccc(-c2nc3ccccc3[n-]2)nc1.
What is the InChIKey of 2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide?
The InChIKey is RLONGTVSYZTIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N3.C11H8N.Pt/c1-2-6-10-9(5-1)14-12(15-10)11-7-3-4-8-13-11;1-2-6-10(7-3-1)11-8-4-5-9-12-11;/h1-8H;1-6,8-9H;/q2*-1;+2.
What are the key properties of 2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide?
2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide has a molecular weight of 543.49 g/mol, XLogP of 4.80, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylpyridine;platinum(2+);2-pyridin-2-ylbenzimidazol-1-ide is sourced from PubChem (CID 20807166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).