N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine

C67H44N2O — CID 135166676

About N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine

N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine (PubChem CID 135166676) has the molecular formula C67H44N2O and a molecular weight of 893.10 g/mol. Its IUPAC name is N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine.

Molecular Properties

• Compound Name: N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
• PubChem CID: 135166676
• Molecular Formula: C67H44N2O
• Molecular Weight: 893.10 g/mol
• Exact Mass: 892.35
• IUPAC Name: N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
• SMILES: c1ccc(-c2ccccc2-c2ccccc2N(c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3N(c3ccccc3)c3ccccc32)c2ccccc2-c2cccc3c2oc2ccccc23)cc1
• InChI: InChI=1S/C67H44N2O/c1-3-22-45(23-4-1)48-26-7-8-27-49(48)52-29-10-16-37-61(52)69(62-38-17-11-30-53(62)55-32-21-33-56-54-31-12-20-41-65(54)70-66(55)56)47-42-43-51-50-28-9-13-34-57(50)67(60(51)44-47)58-35-14-18-39-63(58)68(46-24-5-2-6-25-46)64-40-19-15-36-59(64)67/h1-44H
• InChIKey: ZPIKCFROJWBEEI-UHFFFAOYSA-N
• XLogP: 18.20
• TPSA: 19.62 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 7
• Heavy Atoms: 70
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	893.10
LogP ≤ 5	18.20
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine?

The IUPAC name of N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine (CID 135166676) is N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine.

What is the SMILES notation for N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine?

The canonical SMILES for N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine is c1ccc(-c2ccccc2-c2ccccc2N(c2ccc3c(c2)C2(c4ccccc4-3)c3ccccc3N(c3ccccc3)c3ccccc32)c2ccccc2-c2cccc3c2oc2ccccc23)cc1.

What is the InChIKey of N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine?

The InChIKey is ZPIKCFROJWBEEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H44N2O/c1-3-22-45(23-4-1)48-26-7-8-27-49(48)52-29-10-16-37-61(52)69(62-38-17-11-30-53(62)55-32-21-33-56-54-31-12-20-41-65(54)70-66(55)56)47-42-43-51-50-28-9-13-34-57(50)67(60(51)44-47)58-35-14-18-39-63(58)68(46-24-5-2-6-25-46)64-40-19-15-36-59(64)67/h1-44H.

What are the key properties of N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine?

N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine has a molecular weight of 893.10 g/mol, XLogP of 18.20, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-dibenzofuran-4-ylphenyl)-10-phenyl-N-[2-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine is sourced from PubChem (CID 135166676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).