N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine

C70H59N — CID 170448050

About N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine

N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine (PubChem CID 170448050) has the molecular formula C70H59N and a molecular weight of 914.25 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine.

Molecular Properties

• Compound Name: N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine
• PubChem CID: 170448050
• Molecular Formula: C70H59N
• Molecular Weight: 914.25 g/mol
• Exact Mass: 913.46
• IUPAC Name: N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine
• SMILES: CC1(C)CCC(C)(C)c2c(-c3cc4c(cc3N(c3ccc(-c5ccc6ccccc6c5)cc3)c3ccc5c(c3)C(C)(C)c3ccccc3-5)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cccc21
• InChI: InChI=1S/C70H59N/c1-67(2)40-41-68(3,4)66-57(28-19-31-62(66)67)59-44-58-55-27-16-18-30-61(55)70(50-22-9-7-10-23-50,51-24-11-8-12-25-51)64(58)45-65(59)71(53-38-39-56-54-26-15-17-29-60(54)69(5,6)63(56)43-53)52-36-34-47(35-37-52)49-33-32-46-20-13-14-21-48(46)42-49/h7-39,42-45H,40-41H2,1-6H3
• InChIKey: JHEUAQKDFHNYOB-UHFFFAOYSA-N
• XLogP: 18.66
• TPSA: 3.24 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 7
• Heavy Atoms: 71
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	914.25
LogP ≤ 5	18.66
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine?

The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine (CID 170448050) is N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine.

What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine?

The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine is CC1(C)CCC(C)(C)c2c(-c3cc4c(cc3N(c3ccc(-c5ccc6ccccc6c5)cc3)c3ccc5c(c3)C(C)(C)c3ccccc3-5)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cccc21.

What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine?

The InChIKey is JHEUAQKDFHNYOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H59N/c1-67(2)40-41-68(3,4)66-57(28-19-31-62(66)67)59-44-58-55-27-16-18-30-61(55)70(50-22-9-7-10-23-50,51-24-11-8-12-25-51)64(58)45-65(59)71(53-38-39-56-54-26-15-17-29-60(54)69(5,6)63(56)43-53)52-36-34-47(35-37-52)49-33-32-46-20-13-14-21-48(46)42-49/h7-39,42-45H,40-41H2,1-6H3.

What are the key properties of N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine?

N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine has a molecular weight of 914.25 g/mol, XLogP of 18.66, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for N-(9,9-dimethylfluoren-2-yl)-N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-1-yl)fluoren-2-amine is sourced from PubChem (CID 170448050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).