N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine

C63H42N2 — CID 135166872

About N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine

N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine (PubChem CID 135166872) has the molecular formula C63H42N2 and a molecular weight of 827.04 g/mol. Its IUPAC name is N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine.

Molecular Properties

• Compound Name: N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
• PubChem CID: 135166872
• Molecular Formula: C63H42N2
• Molecular Weight: 827.04 g/mol
• Exact Mass: 826.33
• IUPAC Name: N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
• SMILES: c1ccc(N2c3ccccc3C3(c4ccccc4-c4c(N(c5ccccc5-c5ccccc5-c5cccc6ccccc56)c5cccc6ccccc56)cccc43)c3ccccc32)cc1
• InChI: InChI=1S/C63H42N2/c1-2-25-45(26-3-1)64-59-39-16-13-35-54(59)63(55-36-14-17-40-60(55)64)53-34-12-10-32-52(53)62-56(63)37-20-42-61(62)65(57-41-19-24-44-22-5-7-28-47(44)57)58-38-15-11-31-51(58)50-30-9-8-29-49(50)48-33-18-23-43-21-4-6-27-46(43)48/h1-42H
• InChIKey: UVZZMYQYWXXLNP-UHFFFAOYSA-N
• XLogP: 16.94
• TPSA: 6.48 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 6
• Heavy Atoms: 65
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	827.04
LogP ≤ 5	16.94
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?

The IUPAC name of N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine (CID 135166872) is N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine.

What is the SMILES notation for N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?

The canonical SMILES for N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine is c1ccc(N2c3ccccc3C3(c4ccccc4-c4c(N(c5ccccc5-c5ccccc5-c5cccc6ccccc56)c5cccc6ccccc56)cccc43)c3ccccc32)cc1.

What is the InChIKey of N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?

The InChIKey is UVZZMYQYWXXLNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H42N2/c1-2-25-45(26-3-1)64-59-39-16-13-35-54(59)63(55-36-14-17-40-60(55)64)53-34-12-10-32-52(53)62-56(63)37-20-42-61(62)65(57-41-19-24-44-22-5-7-28-47(44)57)58-38-15-11-31-51(58)50-30-9-8-29-49(50)48-33-18-23-43-21-4-6-27-46(43)48/h1-42H.

What are the key properties of N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?

N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine has a molecular weight of 827.04 g/mol, XLogP of 16.94, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine is sourced from PubChem (CID 135166872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).