2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+)

C22H14N2OPt — CID 58870978

IUPAC2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+)
SMILES[Pt+2].[c-]1ccccc1Oc1cccc(-c2[c-]c(-c3ccccn3)ccc2)n1
InChIInChI=1S/C22H14N2O.Pt/c1-2-10-19(11-3-1)25-22-14-7-13-21(24-22)18-9-6-8-17(16-18)20-12-4-5-15-23-20;/h1-10,12-15H;/q-2;+2
InChIKeyFWGVRDLLEXUPPW-UHFFFAOYSA-N
MW517.45 g/mol
LogP5.20
Rot. Bonds4

About 2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+)

2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+) (PubChem CID 58870978) has the molecular formula C22H14N2OPt and a molecular weight of 517.45 g/mol. Its IUPAC name is 2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+).

Molecular Properties

Compound Name2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+)
PubChem CID58870978
Molecular FormulaC22H14N2OPt
Molecular Weight517.45 g/mol
Exact Mass517.08
IUPAC Name2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+)
SMILES[Pt+2].[c-]1ccccc1Oc1cccc(-c2[c-]c(-c3ccccn3)ccc2)n1
InChIInChI=1S/C22H14N2O.Pt/c1-2-10-19(11-3-1)25-22-14-7-13-21(24-22)18-9-6-8-17(16-18)20-12-4-5-15-23-20;/h1-10,12-15H;/q-2;+2
InChIKeyFWGVRDLLEXUPPW-UHFFFAOYSA-N
XLogP5.20
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500517.45
LogP ≤ 55.20
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

2-fluoro-3-[6-[[6-[2-fluoro-6-(trifluoromethyl)-4H-pyridin-4-id-3-yl]-2-pyridinyl]oxy]-2-pyridinyl]-6-(trifluoromethyl)-4H-pyridin-4-ide;platinum(2+)
CID 57615570
2-(4-fluorobenzene-6-id-1-yl)pyridine;iridium;(2E)-2-(pyridin-2-ylmethylidene)-1,3-benzoxazol-3-ide
CID 21030468
2-(1-methyl-5H-pyrazol-5-id-4-yl)-6-[[6-(1-methyl-5H-pyrazol-5-id-4-yl)-2-pyridinyl]oxy]pyridine;platinum(2+)
CID 57589548
3-[6-[[6-(2,6-difluoro-4H-pyridin-4-id-3-yl)-2-pyridinyl]oxy]-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;platinum(2+)
CID 57615549
3-[6-[[6-(3-Isocyanobenzene-6-id-1-yl)-5-pyridin-4-yl-2-pyridinyl]oxy]-3-pyridin-4-yl-2-pyridinyl]benzene-4-ide-1-carbonitrile;platinum(2+)
CID 57739645
CID 57806497
CID 57806497
CID 57936973
CID 57936973
CID 57936999
CID 57936999
iridium;2-(phenoxy)-6-[1-[6-(4H-pyridin-4-id-3-yl)-2-pyridinyl]propan-2-yl]pyridine
CID 58106765
iridium;2-(phenoxy)-6-[1-[6-(3H-pyridin-3-id-4-yl)-2-pyridinyl]ethyl]pyridine
CID 58106780
Iridium;oxo-[6-(phenoxy)-2-pyridinyl]-(6-phenyl-2-pyridinyl)phosphanium
CID 58106896
Iridium;2-(phenoxy)-6-[1-(6-phenyl-2-pyridinyl)ethyl]pyridine
CID 58106963

Frequently Asked Questions

What is the IUPAC name of 2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+)?
The IUPAC name of 2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+) (CID 58870978) is 2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+).
What is the SMILES notation for 2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+)?
The canonical SMILES for 2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+) is [Pt+2].[c-]1ccccc1Oc1cccc(-c2[c-]c(-c3ccccn3)ccc2)n1.
What is the InChIKey of 2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+)?
The InChIKey is FWGVRDLLEXUPPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14N2O.Pt/c1-2-10-19(11-3-1)25-22-14-7-13-21(24-22)18-9-6-8-17(16-18)20-12-4-5-15-23-20;/h1-10,12-15H;/q-2;+2.
What are the key properties of 2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+)?
2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+) has a molecular weight of 517.45 g/mol, XLogP of 5.20, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(phenoxy)-6-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine;platinum(2+) is sourced from PubChem (CID 58870978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).