2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)

C74H60N2Pt — CID 167327915

About 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)

2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+) (PubChem CID 167327915) has the molecular formula C74H60N2Pt and a molecular weight of 1172.39 g/mol. Its IUPAC name is 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+).

Molecular Properties

• Compound Name: 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)
• PubChem CID: 167327915
• Molecular Formula: C74H60N2Pt
• Molecular Weight: 1172.39 g/mol
• Exact Mass: 1171.44
• IUPAC Name: 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)
• SMILES: [Pt+2].[c-]1c(C(=C(c2ccc(C3CCCCC3)cc2)c2ccc(C3CCCCC3)cc2)c2[c-]c(C3(c4ccccn4)c4ccccc4-c4ccccc43)ccc2)cccc1C1(c2ccccn2)c2ccccc2-c2ccccc21
• InChI: InChI=1S/C74H60N2.Pt/c1-3-21-51(22-4-1)53-39-43-55(44-40-53)71(56-45-41-54(42-46-56)52-23-5-2-6-24-52)72(57-25-19-27-59(49-57)73(69-37-15-17-47-75-69)65-33-11-7-29-61(65)62-30-8-12-34-66(62)73)58-26-20-28-60(50-58)74(70-38-16-18-48-76-70)67-35-13-9-31-63(67)64-32-10-14-36-68(64)74;/h7-20,25-48,51-52H,1-6,21-24H2;/q-2;+2
• InChIKey: HKOOPOJZEBMVMF-UHFFFAOYSA-N
• XLogP: 17.90
• TPSA: 25.78 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 10
• Heavy Atoms: 77
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1172.39
LogP ≤ 5	17.90
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)?

The IUPAC name of 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+) (CID 167327915) is 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+).

What is the SMILES notation for 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)?

The canonical SMILES for 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+) is [Pt+2].[c-]1c(C(=C(c2ccc(C3CCCCC3)cc2)c2ccc(C3CCCCC3)cc2)c2[c-]c(C3(c4ccccn4)c4ccccc4-c4ccccc43)ccc2)cccc1C1(c2ccccn2)c2ccccc2-c2ccccc21.

What is the InChIKey of 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)?

The InChIKey is HKOOPOJZEBMVMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H60N2.Pt/c1-3-21-51(22-4-1)53-39-43-55(44-40-53)71(56-45-41-54(42-46-56)52-23-5-2-6-24-52)72(57-25-19-27-59(49-57)73(69-37-15-17-47-75-69)65-33-11-7-29-61(65)62-30-8-12-34-66(62)73)58-26-20-28-60(50-58)74(70-38-16-18-48-76-70)67-35-13-9-31-63(67)64-32-10-14-36-68(64)74;/h7-20,25-48,51-52H,1-6,21-24H2;/q-2;+2.

What are the key properties of 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+)?

2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+) has a molecular weight of 1172.39 g/mol, XLogP of 17.90, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[9-[3-[2,2-bis(4-cyclohexylphenyl)-1-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]ethenyl]benzene-2-id-1-yl]fluoren-9-yl]pyridine;platinum(2+) is sourced from PubChem (CID 167327915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).