platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine

C23H16F6N4Pt — CID 58831065

About platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine

platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine (PubChem CID 58831065) has the molecular formula C23H16F6N4Pt and a molecular weight of 657.48 g/mol. Its IUPAC name is platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine.

Molecular Properties

• Compound Name: platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine
• PubChem CID: 58831065
• Molecular Formula: C23H16F6N4Pt
• Molecular Weight: 657.48 g/mol
• Exact Mass: 657.09
• IUPAC Name: platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine
• SMILES: CC(C)(c1cccc(-c2cc(C(F)(F)F)c[n-]2)n1)c1cccc(-c2cc(C(F)(F)F)c[n-]2)n1.[Pt+2]
• InChI: InChI=1S/C23H16F6N4.Pt/c1-21(2,19-7-3-5-15(32-19)17-9-13(11-30-17)22(24,25)26)20-8-4-6-16(33-20)18-10-14(12-31-18)23(27,28)29;/h3-12H,1-2H3;/q-2;+2
• InChIKey: WONLCGAHJZMQJA-UHFFFAOYSA-N
• XLogP: 6.09
• TPSA: 53.98 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 4
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	657.48
LogP ≤ 5	6.09
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine?

The IUPAC name of platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine (CID 58831065) is platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine.

What is the SMILES notation for platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine?

The canonical SMILES for platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine is CC(C)(c1cccc(-c2cc(C(F)(F)F)c[n-]2)n1)c1cccc(-c2cc(C(F)(F)F)c[n-]2)n1.[Pt+2].

What is the InChIKey of platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine?

The InChIKey is WONLCGAHJZMQJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16F6N4.Pt/c1-21(2,19-7-3-5-15(32-19)17-9-13(11-30-17)22(24,25)26)20-8-4-6-16(33-20)18-10-14(12-31-18)23(27,28)29;/h3-12H,1-2H3;/q-2;+2.

What are the key properties of platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine?

platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine has a molecular weight of 657.48 g/mol, XLogP of 6.09, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for platinum(2+);2-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-6-[2-[6-[4-(trifluoromethyl)pyrrol-1-id-2-yl]-2-pyridinyl]propan-2-yl]pyridine is sourced from PubChem (CID 58831065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).