4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+)

C36H33F6N5Pt — CID 58661109

About 4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+)

4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+) (PubChem CID 58661109) has the molecular formula C36H33F6N5Pt and a molecular weight of 844.76 g/mol. Its IUPAC name is 4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+).

Molecular Properties

• Compound Name: 4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+)
• PubChem CID: 58661109
• Molecular Formula: C36H33F6N5Pt
• Molecular Weight: 844.76 g/mol
• Exact Mass: 844.23
• IUPAC Name: 4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+)
• SMILES: Cc1cc(C(F)(F)F)c[c-]c1-c1cc(C(C)(C)C)cc(N(c2ccccc2)c2cc(C(C)(C)C)cc(-c3cc(C(F)(F)F)n[n-]3)n2)n1.[Pt+2]
• InChI: InChI=1S/C36H33F6N5.Pt/c1-21-15-22(35(37,38)39)13-14-26(21)27-16-23(33(2,3)4)18-31(43-27)47(25-11-9-8-10-12-25)32-19-24(34(5,6)7)17-28(44-32)29-20-30(46-45-29)36(40,41)42;/h8-13,15-20H,1-7H3;/q-2;+2
• InChIKey: QPVMWOGNRJQALX-UHFFFAOYSA-N
• XLogP: 10.37
• TPSA: 56.01 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 48
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	844.76
LogP ≤ 5	10.37
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

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-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+)?

The IUPAC name of 4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+) (CID 58661109) is 4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+).

What is the SMILES notation for 4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+)?

The canonical SMILES for 4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+) is Cc1cc(C(F)(F)F)c[c-]c1-c1cc(C(C)(C)C)cc(N(c2ccccc2)c2cc(C(C)(C)C)cc(-c3cc(C(F)(F)F)n[n-]3)n2)n1.[Pt+2].

What is the InChIKey of 4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+)?

The InChIKey is QPVMWOGNRJQALX-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H33F6N5.Pt/c1-21-15-22(35(37,38)39)13-14-26(21)27-16-23(33(2,3)4)18-31(43-27)47(25-11-9-8-10-12-25)32-19-24(34(5,6)7)17-28(44-32)29-20-30(46-45-29)36(40,41)42;/h8-13,15-20H,1-7H3;/q-2;+2.

What are the key properties of 4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+)?

4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+) has a molecular weight of 844.76 g/mol, XLogP of 10.37, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 4-tert-butyl-N-[4-tert-butyl-6-[2-methyl-4-(trifluoromethyl)benzene-6-id-1-yl]-2-pyridinyl]-N-phenyl-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-2-amine;platinum(2+) is sourced from PubChem (CID 58661109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).