bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane

C18H22N6OsP2 — CID 58788802

IUPACbis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane
SMILESCc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.P.P.[Os+2]
InChIInChI=1S/2C9H8N3.Os.2H3P/c2*1-7-6-9(12-11-7)8-4-2-3-5-10-8;;;/h2*2-6H,1H3;;2*1H3/q2*-1;+2;;
InChIKeyDPSNZQVKSNKUQX-UHFFFAOYSA-N
MW574.59 g/mol
LogP2.93
Rot. Bonds2

About bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane

bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane (PubChem CID 58788802) has the molecular formula C18H22N6OsP2 and a molecular weight of 574.59 g/mol. Its IUPAC name is bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane.

Molecular Properties

Compound Namebis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane
PubChem CID58788802
Molecular FormulaC18H22N6OsP2
Molecular Weight574.59 g/mol
Exact Mass576.10
IUPAC Namebis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane
SMILESCc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.P.P.[Os+2]
InChIInChI=1S/2C9H8N3.Os.2H3P/c2*1-7-6-9(12-11-7)8-4-2-3-5-10-8;;;/h2*2-6H,1H3;;2*1H3/q2*-1;+2;;
InChIKeyDPSNZQVKSNKUQX-UHFFFAOYSA-N
XLogP2.93
TPSA79.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500574.59
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane?
The IUPAC name of bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane (CID 58788802) is bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane.
What is the SMILES notation for bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane?
The canonical SMILES for bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane is Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.P.P.[Os+2].
What is the InChIKey of bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane?
The InChIKey is DPSNZQVKSNKUQX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C9H8N3.Os.2H3P/c2*1-7-6-9(12-11-7)8-4-2-3-5-10-8;;;/h2*2-6H,1H3;;2*1H3/q2*-1;+2;;.
What are the key properties of bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane?
bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane has a molecular weight of 574.59 g/mol, XLogP of 2.93, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);phosphane is sourced from PubChem (CID 58788802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).