N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine

C78H52N2 — CID 135166722

About N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine

N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine (PubChem CID 135166722) has the molecular formula C78H52N2 and a molecular weight of 1017.29 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine.

Molecular Properties

• Compound Name: N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine
• PubChem CID: 135166722
• Molecular Formula: C78H52N2
• Molecular Weight: 1017.29 g/mol
• Exact Mass: 1016.41
• IUPAC Name: N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine
• SMILES: c1ccc(N2c3ccccc3C3(c4ccccc4-c4ccc(N(c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)c5ccccc5-c5ccccc5-c5cccc6ccccc56)cc43)c3ccccc32)cc1
• InChI: InChI=1S/C78H52N2/c1-4-27-54(28-5-1)77(55-29-6-2-7-30-55)68-40-17-14-36-63(68)65-49-47-57(51-72(65)77)79(74-44-21-16-38-67(74)62-35-13-12-34-61(62)60-39-24-26-53-25-10-11-33-59(53)60)58-48-50-66-64-37-15-18-41-69(64)78(73(66)52-58)70-42-19-22-45-75(70)80(56-31-8-3-9-32-56)76-46-23-20-43-71(76)78/h1-52H
• InChIKey: TVZOEVYWOWKZKX-UHFFFAOYSA-N
• XLogP: 20.15
• TPSA: 6.48 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 8
• Heavy Atoms: 80
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1017.29
LogP ≤ 5	20.15
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine?

The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine (CID 135166722) is N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine.

What is the SMILES notation for N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine?

The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine is c1ccc(N2c3ccccc3C3(c4ccccc4-c4ccc(N(c5ccc6c(c5)C(c5ccccc5)(c5ccccc5)c5ccccc5-6)c5ccccc5-c5ccccc5-c5cccc6ccccc56)cc43)c3ccccc32)cc1.

What is the InChIKey of N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine?

The InChIKey is TVZOEVYWOWKZKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C78H52N2/c1-4-27-54(28-5-1)77(55-29-6-2-7-30-55)68-40-17-14-36-63(68)65-49-47-57(51-72(65)77)79(74-44-21-16-38-67(74)62-35-13-12-34-61(62)60-39-24-26-53-25-10-11-33-59(53)60)58-48-50-66-64-37-15-18-41-69(64)78(73(66)52-58)70-42-19-22-45-75(70)80(56-31-8-3-9-32-56)76-46-23-20-43-71(76)78/h1-52H.

What are the key properties of N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine?

N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine has a molecular weight of 1017.29 g/mol, XLogP of 20.15, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-(9,9-diphenylfluoren-2-yl)-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-2'-amine is sourced from PubChem (CID 135166722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).