2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+)

C24H20F5N3OPt — CID 59646003

About 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+)

2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+) (PubChem CID 59646003) has the molecular formula C24H20F5N3OPt and a molecular weight of 656.51 g/mol. Its IUPAC name is 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+).

Molecular Properties

• Compound Name: 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+)
• PubChem CID: 59646003
• Molecular Formula: C24H20F5N3OPt
• Molecular Weight: 656.51 g/mol
• Exact Mass: 656.12
• IUPAC Name: 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+)
• SMILES: CC(C)([N-]C(=O)C(F)(F)F)c1cccc(C(C)(C)c2cccc(-c3[c-]cc(F)cc3F)n2)n1.[Pt+2]
• InChI: InChI=1S/C24H21F5N3O.Pt/c1-22(2,18-8-5-7-17(30-18)15-12-11-14(25)13-16(15)26)19-9-6-10-20(31-19)23(3,4)32-21(33)24(27,28)29;/h5-11,13H,1-4H3,(H,32,33);/q-1;+2/p-1
• InChIKey: PSHZNVKGHWJNMB-UHFFFAOYSA-M
• XLogP: 6.24
• TPSA: 56.95 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 5
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	656.51
LogP ≤ 5	6.24
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+)?

The IUPAC name of 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+) (CID 59646003) is 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+).

What is the SMILES notation for 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+)?

The canonical SMILES for 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+) is CC(C)([N-]C(=O)C(F)(F)F)c1cccc(C(C)(C)c2cccc(-c3[c-]cc(F)cc3F)n2)n1.[Pt+2].

What is the InChIKey of 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+)?

The InChIKey is PSHZNVKGHWJNMB-UHFFFAOYSA-M. The full InChI is InChI=1S/C24H21F5N3O.Pt/c1-22(2,18-8-5-7-17(30-18)15-12-11-14(25)13-16(15)26)19-9-6-10-20(31-19)23(3,4)32-21(33)24(27,28)29;/h5-11,13H,1-4H3,(H,32,33);/q-1;+2/p-1.

What are the key properties of 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+)?

2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+) has a molecular weight of 656.51 g/mol, XLogP of 6.24, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[6-[2-[6-(2,4-difluorobenzene-6-id-1-yl)-2-pyridinyl]propan-2-yl]-2-pyridinyl]propan-2-yl-(2,2,2-trifluoroacetyl)azanide;platinum(2+) is sourced from PubChem (CID 59646003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).