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

C74H50N2 — CID 155240909

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

N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-[4-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine (PubChem CID 155240909) has the molecular formula C74H50N2 and a molecular weight of 967.23 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-[4-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine.

Molecular Properties

• Compound Name: N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-[4-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
• PubChem CID: 155240909
• Molecular Formula: C74H50N2
• Molecular Weight: 967.23 g/mol
• Exact Mass: 966.40
• IUPAC Name: N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-[4-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine
• SMILES: c1ccc(-c2ccccc2-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4N(c4ccccc4)c4ccccc43)cc2)cc1
• InChI: InChI=1S/C74H50N2/c1-5-23-51(24-6-1)59-31-13-14-32-60(59)52-41-43-56(44-42-52)75(57-45-47-63-61-33-15-17-35-65(61)73(69(63)49-57,53-25-7-2-8-26-53)54-27-9-3-10-28-54)58-46-48-64-62-34-16-18-36-66(62)74(70(64)50-58)67-37-19-21-39-71(67)76(55-29-11-4-12-30-55)72-40-22-20-38-68(72)74/h1-50H
• InChIKey: JOATVAIRDISDFH-UHFFFAOYSA-N
• XLogP: 19.00
• TPSA: 6.48 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 8
• Heavy Atoms: 76
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	967.23
LogP ≤ 5	19.00
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)-10-phenyl-N-[4-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine?

The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-[4-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine (CID 155240909) is N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-[4-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine.

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

The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-[4-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine is c1ccc(-c2ccccc2-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4N(c4ccccc4)c4ccccc43)cc2)cc1.

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

The InChIKey is JOATVAIRDISDFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H50N2/c1-5-23-51(24-6-1)59-31-13-14-32-60(59)52-41-43-56(44-42-52)75(57-45-47-63-61-33-15-17-35-65(61)73(69(63)49-57,53-25-7-2-8-26-53)54-27-9-3-10-28-54)58-46-48-64-62-34-16-18-36-66(62)74(70(64)50-58)67-37-19-21-39-71(67)76(55-29-11-4-12-30-55)72-40-22-20-38-68(72)74/h1-50H.

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

N-(9,9-diphenylfluoren-2-yl)-10-phenyl-N-[4-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine has a molecular weight of 967.23 g/mol, XLogP of 19.00, 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)-10-phenyl-N-[4-(2-phenylphenyl)phenyl]spiro[acridine-9,9'-fluorene]-2'-amine is sourced from PubChem (CID 155240909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).