9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine

C69H57N — CID 170447496

About 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine

9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine (PubChem CID 170447496) has the molecular formula C69H57N and a molecular weight of 900.22 g/mol. Its IUPAC name is 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine.

Molecular Properties

• Compound Name: 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine
• PubChem CID: 170447496
• Molecular Formula: C69H57N
• Molecular Weight: 900.22 g/mol
• Exact Mass: 899.45
• IUPAC Name: 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine
• SMILES: CC1(C)CCC(C)(C)c2cc(-c3cc4c(cc3N(c3ccc(-c5ccccc5)cc3)c3ccc(-c5ccccc5-c5ccccc5)cc3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)ccc21
• InChI: InChI=1S/C69H57N/c1-67(2)43-44-68(3,4)65-45-52(37-42-63(65)67)60-46-61-59-31-19-20-32-62(59)69(53-25-13-7-14-26-53,54-27-15-8-16-28-54)64(61)47-66(60)70(55-38-33-49(34-39-55)48-21-9-5-10-22-48)56-40-35-51(36-41-56)58-30-18-17-29-57(58)50-23-11-6-12-24-50/h5-42,45-47H,43-44H2,1-4H3
• InChIKey: JIANQDXJHXPMRF-UHFFFAOYSA-N
• XLogP: 18.54
• TPSA: 3.24 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 9
• Heavy Atoms: 70
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	900.22
LogP ≤ 5	18.54
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine?

The IUPAC name of 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine (CID 170447496) is 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine.

What is the SMILES notation for 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine?

The canonical SMILES for 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine is CC1(C)CCC(C)(C)c2cc(-c3cc4c(cc3N(c3ccc(-c5ccccc5)cc3)c3ccc(-c5ccccc5-c5ccccc5)cc3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)ccc21.

What is the InChIKey of 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine?

The InChIKey is JIANQDXJHXPMRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H57N/c1-67(2)43-44-68(3,4)65-45-52(37-42-63(65)67)60-46-61-59-31-19-20-32-62(59)69(53-25-13-7-14-26-53,54-27-15-8-16-28-54)64(61)47-66(60)70(55-38-33-49(34-39-55)48-21-9-5-10-22-48)56-40-35-51(36-41-56)58-30-18-17-29-57(58)50-23-11-6-12-24-50/h5-42,45-47H,43-44H2,1-4H3.

What are the key properties of 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine?

9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine has a molecular weight of 900.22 g/mol, XLogP of 18.54, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)fluoren-2-amine is sourced from PubChem (CID 170447496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).