platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine

C22H14N2OPt — CID 58871074

IUPACplatinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine
SMILES[Pt+2].[c-]1c(Oc2ccccn2)cccc1-c1[c-]c(-c2ccccn2)ccc1
InChIInChI=1S/C22H14N2O.Pt/c1-3-13-23-21(11-1)19-9-5-7-17(15-19)18-8-6-10-20(16-18)25-22-12-2-4-14-24-22;/h1-14H;/q-2;+2
InChIKeyBJECJOWCMCLNQX-UHFFFAOYSA-N
MW517.45 g/mol
LogP5.20
Rot. Bonds4

About platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine

platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine (PubChem CID 58871074) has the molecular formula C22H14N2OPt and a molecular weight of 517.45 g/mol. Its IUPAC name is platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine.

Molecular Properties

Compound Nameplatinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine
PubChem CID58871074
Molecular FormulaC22H14N2OPt
Molecular Weight517.45 g/mol
Exact Mass517.08
IUPAC Nameplatinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine
SMILES[Pt+2].[c-]1c(Oc2ccccn2)cccc1-c1[c-]c(-c2ccccn2)ccc1
InChIInChI=1S/C22H14N2O.Pt/c1-3-13-23-21(11-1)19-9-5-7-17(15-19)18-8-6-10-20(16-18)25-22-12-2-4-14-24-22;/h1-14H;/q-2;+2
InChIKeyBJECJOWCMCLNQX-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'}

Analyze platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

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-[3-[5-(4-methyl-2-pyridinyl)-4H-benzo[b][1]benzobismol-4-id-3-yl]benzene-2-id-1-yl]oxy-3-(trifluoromethyl)pyridine;platinum(2+)
CID 153421598
2-[3-[5-(4-methyl-2-pyridinyl)-4H-benzo[b][1]benzobismol-4-id-3-yl]benzene-2-id-1-yl]oxy-4-(trifluoromethyl)pyridine;platinum(2+)
CID 153421766
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
2-(2,4-Difluorobenzene-6-id-1-yl)pyridine;2-(4-fluorobenzene-6-id-1-yl)-4-methoxypyridine;iridium
CID 57615809
CID 57806497
CID 57806497
Bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine);platinum(2+)
CID 57872516
Bis(2-(3,4-dimethoxybenzene-6-id-1-yl)-4-methoxypyridine);platinum(2+)
CID 57872544
Bis(4-methoxy-2-(3-methylbenzene-2-id-1-yl)pyridine);platinum(2+)
CID 57872620
Bis(2-(2,4-dimethylbenzene-6-id-1-yl)-4-methoxypyridine);platinum(2+)
CID 57872963

Frequently Asked Questions

What is the IUPAC name of platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine?
The IUPAC name of platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine (CID 58871074) is platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine.
What is the SMILES notation for platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine?
The canonical SMILES for platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine is [Pt+2].[c-]1c(Oc2ccccn2)cccc1-c1[c-]c(-c2ccccn2)ccc1.
What is the InChIKey of platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine?
The InChIKey is BJECJOWCMCLNQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14N2O.Pt/c1-3-13-23-21(11-1)19-9-5-7-17(15-19)18-8-6-10-20(16-18)25-22-12-2-4-14-24-22;/h1-14H;/q-2;+2.
What are the key properties of platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine?
platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine 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 platinum(2+);2-[3-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine is sourced from PubChem (CID 58871074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).