phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+)

C24H19N3O2Pt — CID 58709094

About phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+)

phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+) (PubChem CID 58709094) has the molecular formula C24H19N3O2Pt and a molecular weight of 576.51 g/mol. Its IUPAC name is phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+).

Molecular Properties

• Compound Name: phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+)
• PubChem CID: 58709094
• Molecular Formula: C24H19N3O2Pt
• Molecular Weight: 576.51 g/mol
• Exact Mass: 576.11
• IUPAC Name: phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+)
• SMILES: CC(C)(c1[c-]c(Oc2ccccn2)ccc1)c1ccn(C(=O)c2[c-]cccc2)n1.[Pt+2]
• InChI: InChI=1S/C24H19N3O2.Pt/c1-24(2,19-11-8-12-20(17-19)29-22-13-6-7-15-25-22)21-14-16-27(26-21)23(28)18-9-4-3-5-10-18;/h3-9,11-16H,1-2H3;/q-2;+2
• InChIKey: JEDORTJISSNSMC-UHFFFAOYSA-N
• XLogP: 4.68
• TPSA: 57.01 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	576.51
LogP ≤ 5	4.68
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+)?

The IUPAC name of phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+) (CID 58709094) is phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+).

What is the SMILES notation for phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+)?

The canonical SMILES for phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+) is CC(C)(c1[c-]c(Oc2ccccn2)ccc1)c1ccn(C(=O)c2[c-]cccc2)n1.[Pt+2].

What is the InChIKey of phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+)?

The InChIKey is JEDORTJISSNSMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O2.Pt/c1-24(2,19-11-8-12-20(17-19)29-22-13-6-7-15-25-22)21-14-16-27(26-21)23(28)18-9-4-3-5-10-18;/h3-9,11-16H,1-2H3;/q-2;+2.

What are the key properties of phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+)?

phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+) has a molecular weight of 576.51 g/mol, XLogP of 4.68, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for phenyl-[3-[2-(3-pyridin-2-yloxybenzene-2-id-1-yl)propan-2-yl]pyrazol-1-yl]methanone;platinum(2+) is sourced from PubChem (CID 58709094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).