platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid

C17H11N2O3Pt- — CID 58709128

IUPACplatinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(Oc2[c-]c(-c3ccccn3)ccc2)n1.[Pt]
InChIInChI=1S/C17H11N2O3.Pt/c20-17(21)15-8-4-9-16(19-15)22-13-6-3-5-12(11-13)14-7-1-2-10-18-14;/h1-10H,(H,20,21);/q-1;
InChIKeyOWUYAUZINTWBAY-UHFFFAOYSA-N
MW486.36 g/mol
LogP3.43
Rot. Bonds4

About platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid

platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid (PubChem CID 58709128) has the molecular formula C17H11N2O3Pt- and a molecular weight of 486.36 g/mol. Its IUPAC name is platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid.

Molecular Properties

Compound Nameplatinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid
PubChem CID58709128
Molecular FormulaC17H11N2O3Pt-
Molecular Weight486.36 g/mol
Exact Mass486.04
IUPAC Nameplatinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(Oc2[c-]c(-c3ccccn3)ccc2)n1.[Pt]
InChIInChI=1S/C17H11N2O3.Pt/c20-17(21)15-8-4-9-16(19-15)22-13-6-3-5-12(11-13)14-7-1-2-10-18-14;/h1-10H,(H,20,21);/q-1;
InChIKeyOWUYAUZINTWBAY-UHFFFAOYSA-N
XLogP3.43
TPSA72.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.36
LogP ≤ 53.43
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 platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid?
The IUPAC name of platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid (CID 58709128) is platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid.
What is the SMILES notation for platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid?
The canonical SMILES for platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid is O=C(O)c1cccc(Oc2[c-]c(-c3ccccn3)ccc2)n1.[Pt].
What is the InChIKey of platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid?
The InChIKey is OWUYAUZINTWBAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N2O3.Pt/c20-17(21)15-8-4-9-16(19-15)22-13-6-3-5-12(11-13)14-7-1-2-10-18-14;/h1-10H,(H,20,21);/q-1;.
What are the key properties of platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid?
platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid has a molecular weight of 486.36 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for platinum;6-(3-pyridin-2-ylbenzene-2-id-1-yl)oxypyridine-2-carboxylic acid is sourced from PubChem (CID 58709128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).