N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine

C94H76N2 — CID 59246228

About N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine

N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine (PubChem CID 59246228) has the molecular formula C94H76N2 and a molecular weight of 1233.66 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine.

Molecular Properties

• Compound Name: N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
• PubChem CID: 59246228
• Molecular Formula: C94H76N2
• Molecular Weight: 1233.66 g/mol
• Exact Mass: 1232.60
• IUPAC Name: N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
• SMILES: CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(C)(C)c3cc(/C=C/c5ccc(-c6ccc(-c7ccc(/C=C/c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccccc%10)c%10ccc%11c(c%10)C(C)(C)c%10ccccc%10-%11)ccc8-9)cc7)cc6)cc5)ccc3-4)cc21
• InChI: InChI=1S/C94H76N2/c1-91(2)83-25-17-15-23-75(83)79-51-45-71(57-87(79)91)95(69-19-11-9-12-20-69)73-47-53-81-77-49-35-63(55-85(77)93(5,6)89(81)59-73)29-27-61-31-37-65(38-32-61)67-41-43-68(44-42-67)66-39-33-62(34-40-66)28-30-64-36-50-78-82-54-48-74(60-90(82)94(7,8)86(78)56-64)96(70-21-13-10-14-22-70)72-46-52-80-76-24-16-18-26-84(76)92(3,4)88(80)58-72/h9-60H,1-8H3/b29-27+,30-28+
• InChIKey: SSTGRYDZQAXQJL-QAVVBOBSSA-N
• XLogP: 25.53
• TPSA: 6.48 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 12
• Heavy Atoms: 96
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1233.66
LogP ≤ 5	25.53
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?

The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine (CID 59246228) is N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine.

What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?

The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(C)(C)c3cc(/C=C/c5ccc(-c6ccc(-c7ccc(/C=C/c8ccc9c(c8)C(C)(C)c8cc(N(c%10ccccc%10)c%10ccc%11c(c%10)C(C)(C)c%10ccccc%10-%11)ccc8-9)cc7)cc6)cc5)ccc3-4)cc21.

What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?

The InChIKey is SSTGRYDZQAXQJL-QAVVBOBSSA-N. The full InChI is InChI=1S/C94H76N2/c1-91(2)83-25-17-15-23-75(83)79-51-45-71(57-87(79)91)95(69-19-11-9-12-20-69)73-47-53-81-77-49-35-63(55-85(77)93(5,6)89(81)59-73)29-27-61-31-37-65(38-32-61)67-41-43-68(44-42-67)66-39-33-62(34-40-66)28-30-64-36-50-78-82-54-48-74(60-90(82)94(7,8)86(78)56-64)96(70-21-13-10-14-22-70)72-46-52-80-76-24-16-18-26-84(76)92(3,4)88(80)58-72/h9-60H,1-8H3/b29-27+,30-28+.

What are the key properties of N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine?

N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine has a molecular weight of 1233.66 g/mol, XLogP of 25.53, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine is sourced from PubChem (CID 59246228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).