4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+)

C29H33F3N6Pt — CID 58444843

About 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+)

4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+) (PubChem CID 58444843) has the molecular formula C29H33F3N6Pt and a molecular weight of 717.70 g/mol. Its IUPAC name is 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+).

Molecular Properties

• Compound Name: 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+)
• PubChem CID: 58444843
• Molecular Formula: C29H33F3N6Pt
• Molecular Weight: 717.70 g/mol
• Exact Mass: 717.24
• IUPAC Name: 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+)
• SMILES: Cc1c[c-]n(-c2cc(C(C)(C)C)cc(C(C)(C)c3cc(C(C)(C)C)cc(-n4[c-]cc(C(F)(F)F)n4)n3)n2)n1.[Pt+2]
• InChI: InChI=1S/C29H33F3N6.Pt/c1-18-10-12-37(35-18)24-16-19(26(2,3)4)14-22(33-24)28(8,9)23-15-20(27(5,6)7)17-25(34-23)38-13-11-21(36-38)29(30,31)32;/h10-11,14-17H,1-9H3;/q-2;+2
• InChIKey: MFFPABHJVIWSBZ-UHFFFAOYSA-N
• XLogP: 6.69
• TPSA: 61.42 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 39
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	717.70
LogP ≤ 5	6.69
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+)?

The IUPAC name of 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+) (CID 58444843) is 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+).

What is the SMILES notation for 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+)?

The canonical SMILES for 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+) is Cc1c[c-]n(-c2cc(C(C)(C)C)cc(C(C)(C)c3cc(C(C)(C)C)cc(-n4[c-]cc(C(F)(F)F)n4)n3)n2)n1.[Pt+2].

What is the InChIKey of 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+)?

The InChIKey is MFFPABHJVIWSBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H33F3N6.Pt/c1-18-10-12-37(35-18)24-16-19(26(2,3)4)14-22(33-24)28(8,9)23-15-20(27(5,6)7)17-25(34-23)38-13-11-21(36-38)29(30,31)32;/h10-11,14-17H,1-9H3;/q-2;+2.

What are the key properties of 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+)?

4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+) has a molecular weight of 717.70 g/mol, XLogP of 6.69, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-2-[2-[4-tert-butyl-6-(3-methyl-5H-pyrazol-5-id-1-yl)-2-pyridinyl]propan-2-yl]-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]pyridine;platinum(2+) is sourced from PubChem (CID 58444843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).