3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum

C21H15FN3OPt- — CID 58636199

IUPAC3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum
SMILESOc1ccccc1F.[Pt].[c-]1c(-c2ccccn2)cncc1-c1ccccn1
InChIInChI=1S/C15H10N3.C6H5FO.Pt/c1-3-7-17-14(5-1)12-9-13(11-16-10-12)15-6-2-4-8-18-15;7-5-3-1-2-4-6(5)8;/h1-8,10-11H;1-4,8H;/q-1;;
InChIKeyXKELIPWYJMIQOH-UHFFFAOYSA-N
MW539.45 g/mol
LogP4.53
Rot. Bonds2

About 3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum

3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum (PubChem CID 58636199) has the molecular formula C21H15FN3OPt- and a molecular weight of 539.45 g/mol. Its IUPAC name is 3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum.

Molecular Properties

Compound Name3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum
PubChem CID58636199
Molecular FormulaC21H15FN3OPt-
Molecular Weight539.45 g/mol
Exact Mass539.09
IUPAC Name3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum
SMILESOc1ccccc1F.[Pt].[c-]1c(-c2ccccn2)cncc1-c1ccccn1
InChIInChI=1S/C15H10N3.C6H5FO.Pt/c1-3-7-17-14(5-1)12-9-13(11-16-10-12)15-6-2-4-8-18-15;7-5-3-1-2-4-6(5)8;/h1-8,10-11H;1-4,8H;/q-1;;
InChIKeyXKELIPWYJMIQOH-UHFFFAOYSA-N
XLogP4.53
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500539.45
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum?
The IUPAC name of 3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum (CID 58636199) is 3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum.
What is the SMILES notation for 3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum?
The canonical SMILES for 3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum is Oc1ccccc1F.[Pt].[c-]1c(-c2ccccn2)cncc1-c1ccccn1.
What is the InChIKey of 3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum?
The InChIKey is XKELIPWYJMIQOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N3.C6H5FO.Pt/c1-3-7-17-14(5-1)12-9-13(11-16-10-12)15-6-2-4-8-18-15;7-5-3-1-2-4-6(5)8;/h1-8,10-11H;1-4,8H;/q-1;;.
What are the key properties of 3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum?
3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum has a molecular weight of 539.45 g/mol, XLogP of 4.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dipyridin-2-yl-4H-pyridin-4-ide;2-fluorophenol;platinum is sourced from PubChem (CID 58636199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).