N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine

C77H74N4Si2 — CID 59245955

About N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine

N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine (PubChem CID 59245955) has the molecular formula C77H74N4Si2 and a molecular weight of 1111.64 g/mol. Its IUPAC name is N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine.

Molecular Properties

• Compound Name: N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine
• PubChem CID: 59245955
• Molecular Formula: C77H74N4Si2
• Molecular Weight: 1111.64 g/mol
• Exact Mass: 1110.55
• IUPAC Name: N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine
• SMILES: CC1(C)c2cc(/C=C/c3ccc4c(c3)C(C)(C)c3cc(N(c5ccncc5)c5ccc([Si](C)(C)C)cc5)ccc3-4)ccc2-c2ccc(/C=C/c3ccc4c(c3)C(C)(C)c3cc(N(c5ccncc5)c5ccc([Si](C)(C)C)cc5)ccc3-4)cc21
• InChI: InChI=1S/C77H74N4Si2/c1-75(2)69-45-51(13-15-53-19-33-65-67-35-25-59(49-73(67)76(3,4)71(65)47-53)80(57-37-41-78-42-38-57)55-21-27-61(28-22-55)82(7,8)9)17-31-63(69)64-32-18-52(46-70(64)75)14-16-54-20-34-66-68-36-26-60(50-74(68)77(5,6)72(66)48-54)81(58-39-43-79-44-40-58)56-23-29-62(30-24-56)83(10,11)12/h13-50H,1-12H3/b15-13+,16-14+
• InChIKey: NDLRFYMIYRPPHW-WXUKJITCSA-N
• XLogP: 19.77
• TPSA: 32.26 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 12
• Heavy Atoms: 83
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1111.64
LogP ≤ 5	19.77
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine?

The IUPAC name of N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine (CID 59245955) is N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine.

What is the SMILES notation for N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine?

The canonical SMILES for N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine is CC1(C)c2cc(/C=C/c3ccc4c(c3)C(C)(C)c3cc(N(c5ccncc5)c5ccc([Si](C)(C)C)cc5)ccc3-4)ccc2-c2ccc(/C=C/c3ccc4c(c3)C(C)(C)c3cc(N(c5ccncc5)c5ccc([Si](C)(C)C)cc5)ccc3-4)cc21.

What is the InChIKey of N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine?

The InChIKey is NDLRFYMIYRPPHW-WXUKJITCSA-N. The full InChI is InChI=1S/C77H74N4Si2/c1-75(2)69-45-51(13-15-53-19-33-65-67-35-25-59(49-73(67)76(3,4)71(65)47-53)80(57-37-41-78-42-38-57)55-21-27-61(28-22-55)82(7,8)9)17-31-63(69)64-32-18-52(46-70(64)75)14-16-54-20-34-66-68-36-26-60(50-74(68)77(5,6)72(66)48-54)81(58-39-43-79-44-40-58)56-23-29-62(30-24-56)83(10,11)12/h13-50H,1-12H3/b15-13+,16-14+.

What are the key properties of N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine?

N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine has a molecular weight of 1111.64 g/mol, XLogP of 19.77, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[7-[(E)-2-[7-[(E)-2-[9,9-dimethyl-7-(N-pyridin-4-yl-4-trimethylsilylanilino)fluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]ethenyl]-9,9-dimethylfluoren-2-yl]-N-(4-trimethylsilylphenyl)pyridin-4-amine is sourced from PubChem (CID 59245955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).