2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+)

C20H14N4O2Pt — CID 140579807

IUPAC2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+)
SMILESCc1cc(-c2cccc(Oc3[c-]c(Oc4ccccn4)ccc3)n2)[n-]n1.[Pt+2]
InChIInChI=1S/C20H14N4O2.Pt/c1-14-12-18(24-23-14)17-8-5-10-20(22-17)26-16-7-4-6-15(13-16)25-19-9-2-3-11-21-19;/h2-12H,1H3;/q-2;+2
InChIKeyAWMRIVVSWJRZPX-UHFFFAOYSA-N
MW537.44 g/mol
LogP4.19
Rot. Bonds5

About 2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+)

2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+) (PubChem CID 140579807) has the molecular formula C20H14N4O2Pt and a molecular weight of 537.44 g/mol. Its IUPAC name is 2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+).

Molecular Properties

Compound Name2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+)
PubChem CID140579807
Molecular FormulaC20H14N4O2Pt
Molecular Weight537.44 g/mol
Exact Mass537.08
IUPAC Name2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+)
SMILESCc1cc(-c2cccc(Oc3[c-]c(Oc4ccccn4)ccc3)n2)[n-]n1.[Pt+2]
InChIInChI=1S/C20H14N4O2.Pt/c1-14-12-18(24-23-14)17-8-5-10-20(22-17)26-16-7-4-6-15(13-16)25-19-9-2-3-11-21-19;/h2-12H,1H3;/q-2;+2
InChIKeyAWMRIVVSWJRZPX-UHFFFAOYSA-N
XLogP4.19
TPSA71.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500537.44
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-phenoxy-2-[2-(1-phenylpyrazol-3-yl)propan-2-yl]-6-[6-(trifluoromethyl)-3H-pyridin-3-id-2-yl]pyridine;platinum(2+)
CID 57923425
2,6-difluoro-3-[4-phenoxy-6-[2-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]propan-2-yl]-2-pyridinyl]-4H-pyridin-4-ide;platinum(2+)
CID 57923529
2-(5-Methylpyrazol-2-id-3-yl)-6-[[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]oxy]pyridine;platinum(2+)
CID 58831058
Platinum(2+);2-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 164849078
3-(2,4-Difluorobenzene-6-id-1-yl)-6-methoxypyridazine;platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 168793695
3-(4-Tert-butylbenzene-6-id-1-yl)-6-methoxypyridazine;platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 168793700
3-Methoxy-6-phenylpyridazine;platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 168793709
3-Methoxy-6-(4-methoxybenzene-6-id-1-yl)pyridazine;platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 168793717
3-Methoxy-6-(4-methoxybenzene-6-id-1-yl)pyridazine;platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyrazine
CID 168793721
3-(4-Fluorobenzene-6-id-1-yl)-6-methoxypyridazine;platinum(2+);2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 168793722
7-(6-Ethoxy-3-pyridazinyl)pyrazolo[1,5-a]pyridine
CID 56919160
4-[2-(6-Ethoxy-pyridin-2-yl)-pyrazolo[1,5-a]pyridin-3-yl]-quinoline
CID 10474077

Frequently Asked Questions

What is the IUPAC name of 2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+)?
The IUPAC name of 2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+) (CID 140579807) is 2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+).
What is the SMILES notation for 2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+)?
The canonical SMILES for 2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+) is Cc1cc(-c2cccc(Oc3[c-]c(Oc4ccccn4)ccc3)n2)[n-]n1.[Pt+2].
What is the InChIKey of 2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+)?
The InChIKey is AWMRIVVSWJRZPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N4O2.Pt/c1-14-12-18(24-23-14)17-8-5-10-20(22-17)26-16-7-4-6-15(13-16)25-19-9-2-3-11-21-19;/h2-12H,1H3;/q-2;+2.
What are the key properties of 2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+)?
2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+) has a molecular weight of 537.44 g/mol, XLogP of 4.19, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylpyrazol-2-id-3-yl)-6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine;platinum(2+) is sourced from PubChem (CID 140579807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).