N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine

C74H50N2 — CID 155240030

About N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine

N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine (PubChem CID 155240030) has the molecular formula C74H50N2 and a molecular weight of 967.23 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine.

Molecular Properties

• Compound Name: N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
• PubChem CID: 155240030
• Molecular Formula: C74H50N2
• Molecular Weight: 967.23 g/mol
• Exact Mass: 966.40
• IUPAC Name: N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
• SMILES: c1ccc(-c2cc(-c3ccccc3)cc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3cccc4c3-c3ccccc3C43c4ccccc4N(c4ccccc4)c4ccccc43)c2)cc1
• InChI: InChI=1S/C74H50N2/c1-6-25-51(26-7-1)53-47-54(52-27-8-2-9-28-52)49-59(48-53)75(58-45-46-61-60-35-16-18-37-63(60)73(68(61)50-58,55-29-10-3-11-30-55)56-31-12-4-13-32-56)71-44-24-41-67-72(71)62-36-17-19-38-64(62)74(67)65-39-20-22-42-69(65)76(57-33-14-5-15-34-57)70-43-23-21-40-66(70)74/h1-50H
• InChIKey: IUCWKDMVYZHXMB-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)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?

The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine (CID 155240030) is N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine.

What is the SMILES notation for N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?

The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine is c1ccc(-c2cc(-c3ccccc3)cc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3cccc4c3-c3ccccc3C43c4ccccc4N(c4ccccc4)c4ccccc43)c2)cc1.

What is the InChIKey of N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?

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

What are the key properties of N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine?

N-(9,9-diphenylfluoren-2-yl)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-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)-N-(3,5-diphenylphenyl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine is sourced from PubChem (CID 155240030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).