N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine

C114H76N2 — CID 167247172

About N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine

N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine (PubChem CID 167247172) has the molecular formula C114H76N2 and a molecular weight of 1473.88 g/mol. Its IUPAC name is N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine.

Molecular Properties

• Compound Name: N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine
• PubChem CID: 167247172
• Molecular Formula: C114H76N2
• Molecular Weight: 1473.88 g/mol
• Exact Mass: 1472.60
• IUPAC Name: N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine
• SMILES: c1ccc(C2(c3ccc(-c4ccc5cccc(-c6ccc(N(c7cccc(-c8cccc9ccccc89)c7)c7cccc8c7-c7ccccc7C8(c7ccccc7)c7ccccc7)cc6)c5c4)cc3)c3ccccc3-c3c(N(c4ccc(-c5cccc6ccccc56)cc4)c4cccc(-c5ccc6ccccc6c5)c4)cccc32)cc1
• InChI: InChI=1S/C114H76N2/c1-4-36-89(37-5-1)113(90-38-6-2-7-39-90)105-51-18-16-46-102(105)111-107(113)53-25-56-110(111)116(96-43-21-35-88(75-96)101-50-23-32-80-29-13-15-45-98(80)101)94-71-65-83(66-72-94)100-49-24-33-81-58-60-87(76-104(81)100)78-61-67-92(68-62-78)114(91-40-8-3-9-41-91)106-52-19-17-47-103(106)112-108(114)54-26-55-109(112)115(93-69-63-82(64-70-93)99-48-22-31-79-28-12-14-44-97(79)99)95-42-20-34-85(74-95)86-59-57-77-27-10-11-30-84(77)73-86/h1-76H
• InChIKey: LUNOCYGVMUNWAG-UHFFFAOYSA-N
• XLogP: 30.30
• TPSA: 6.48 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 15
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1473.88
LogP ≤ 5	30.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine?

The IUPAC name of N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine (CID 167247172) is N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine.

What is the SMILES notation for N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine?

The canonical SMILES for N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine is c1ccc(C2(c3ccc(-c4ccc5cccc(-c6ccc(N(c7cccc(-c8cccc9ccccc89)c7)c7cccc8c7-c7ccccc7C8(c7ccccc7)c7ccccc7)cc6)c5c4)cc3)c3ccccc3-c3c(N(c4ccc(-c5cccc6ccccc56)cc4)c4cccc(-c5ccc6ccccc6c5)c4)cccc32)cc1.

What is the InChIKey of N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine?

The InChIKey is LUNOCYGVMUNWAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C114H76N2/c1-4-36-89(37-5-1)113(90-38-6-2-7-39-90)105-51-18-16-46-102(105)111-107(113)53-25-56-110(111)116(96-43-21-35-88(75-96)101-50-23-32-80-29-13-15-45-98(80)101)94-71-65-83(66-72-94)100-49-24-33-81-58-60-87(76-104(81)100)78-61-67-92(68-62-78)114(91-40-8-3-9-41-91)106-52-19-17-47-103(106)112-108(114)54-26-55-109(112)115(93-69-63-82(64-70-93)99-48-22-31-79-28-12-14-44-97(79)99)95-42-20-34-85(74-95)86-59-57-77-27-10-11-30-84(77)73-86/h1-76H.

What are the key properties of N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine?

N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine has a molecular weight of 1473.88 g/mol, XLogP of 30.30, 15 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[7-[4-[4-(4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)anilino)-9-phenylfluoren-9-yl]phenyl]naphthalen-1-yl]phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine is sourced from PubChem (CID 167247172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).