N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)

C64H51F5N8Pt — CID 59372125

About N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)

N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+) (PubChem CID 59372125) has the molecular formula C64H51F5N8Pt and a molecular weight of 1222.24 g/mol. Its IUPAC name is N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+).

Molecular Properties

• Compound Name: N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)
• PubChem CID: 59372125
• Molecular Formula: C64H51F5N8Pt
• Molecular Weight: 1222.24 g/mol
• Exact Mass: 1221.38
• IUPAC Name: N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)
• SMILES: CCC(CC(C)n1c2ccccc2c2ccccc21)c1ccc(N(c2ccccc2)c2cc(-c3[c-]cc(F)nc3F)nc(C(C)(C)c3cc(N(c4ccccc4)c4ccccc4)cc(-n4[c-]cc(C(F)(F)F)n4)n3)c2)cc1.[Pt+2]
• InChI: InChI=1S/C64H51F5N8.Pt/c1-5-43(37-42(2)75-55-27-17-15-25-51(55)52-26-16-18-28-56(52)75)44-29-31-48(32-30-44)77(47-23-13-8-14-24-47)49-38-54(53-33-34-60(65)72-62(53)66)70-58(39-49)63(3,4)59-40-50(41-61(71-59)74-36-35-57(73-74)64(67,68)69)76(45-19-9-6-10-20-45)46-21-11-7-12-22-46;/h6-32,34-35,38-43H,5,37H2,1-4H3;/q-2;+2
• InChIKey: XVPASWREHNVHOC-UHFFFAOYSA-N
• XLogP: 17.14
• TPSA: 67.90 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 15
• Heavy Atoms: 78
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1222.24
LogP ≤ 5	17.14
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)?

The IUPAC name of N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+) (CID 59372125) is N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+).

What is the SMILES notation for N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)?

The canonical SMILES for N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+) is CCC(CC(C)n1c2ccccc2c2ccccc21)c1ccc(N(c2ccccc2)c2cc(-c3[c-]cc(F)nc3F)nc(C(C)(C)c3cc(N(c4ccccc4)c4ccccc4)cc(-n4[c-]cc(C(F)(F)F)n4)n3)c2)cc1.[Pt+2].

What is the InChIKey of N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)?

The InChIKey is XVPASWREHNVHOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H51F5N8.Pt/c1-5-43(37-42(2)75-55-27-17-15-25-51(55)52-26-16-18-28-56(52)75)44-29-31-48(32-30-44)77(47-23-13-8-14-24-47)49-38-54(53-33-34-60(65)72-62(53)66)70-58(39-49)63(3,4)59-40-50(41-61(71-59)74-36-35-57(73-74)64(67,68)69)76(45-19-9-6-10-20-45)46-21-11-7-12-22-46;/h6-32,34-35,38-43H,5,37H2,1-4H3;/q-2;+2.

What are the key properties of N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+)?

N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+) has a molecular weight of 1222.24 g/mol, XLogP of 17.14, 15 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(5-carbazol-9-ylhexan-3-yl)phenyl]-2-(2,6-difluoro-4H-pyridin-4-id-3-yl)-N-phenyl-6-[2-[4-(N-phenylanilino)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]propan-2-yl]pyridin-4-amine;platinum(2+) is sourced from PubChem (CID 59372125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).