N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine

C63H49N — CID 170292168

IUPACN-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
SMILESCC(C)(C)c1ccc(-c2ccccc2)c(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)c2ccccc2-c2cccc3cccc(-c4ccccc4)c23)c1
InChIInChI=1S/C63H49N/c1-62(2,3)49-38-40-51(44-22-8-4-9-23-44)60(42-49)64(59-37-19-17-33-55(59)56-35-21-27-46-26-20-34-52(61(46)56)45-24-10-5-11-25-45)50-39-41-54-53-32-16-18-36-57(53)63(58(54)43-50,47-28-12-6-13-29-47)48-30-14-7-15-31-48/h4-43H,1-3H3
InChIKeyFVZMUDMNZYGNBS-UHFFFAOYSA-N
MW820.09 g/mol
LogP16.97
Rot. Bonds8

About N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine

N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine (PubChem CID 170292168) has the molecular formula C63H49N and a molecular weight of 820.09 g/mol. Its IUPAC name is N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine.

Molecular Properties

Compound NameN-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
PubChem CID170292168
Molecular FormulaC63H49N
Molecular Weight820.09 g/mol
Exact Mass819.39
IUPAC NameN-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine
SMILESCC(C)(C)c1ccc(-c2ccccc2)c(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)c2ccccc2-c2cccc3cccc(-c4ccccc4)c23)c1
InChIInChI=1S/C63H49N/c1-62(2,3)49-38-40-51(44-22-8-4-9-23-44)60(42-49)64(59-37-19-17-33-55(59)56-35-21-27-46-26-20-34-52(61(46)56)45-24-10-5-11-25-45)50-39-41-54-53-32-16-18-36-57(53)63(58(54)43-50,47-28-12-6-13-29-47)48-30-14-7-15-31-48/h4-43H,1-3H3
InChIKeyFVZMUDMNZYGNBS-UHFFFAOYSA-N
XLogP16.97
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500820.09
LogP ≤ 516.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-tert-butylphenyl)-2-(9,9-diphenylfluoren-2-yl)-N-[2-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170291967
2',7'-ditert-butyl-N-[2-[8-(3,5-ditert-butylphenyl)naphthalen-1-yl]phenyl]-N-(2-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 170304818
4-tert-butyl-N-[2-(9,9-diphenylfluoren-2-yl)phenyl]-2-phenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170291910
3,5-ditert-butyl-N-[2-(9,9-diphenylfluoren-2-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170291584
N-(4-tert-butylphenyl)-N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-2-(8-phenylnaphthalen-1-yl)aniline
CID 170291958
N-[2-[8-(3,5-ditert-butylphenyl)naphthalen-1-yl]phenyl]-N-[2-(9,9-diphenylfluoren-2-yl)phenyl]-2,4-diphenylaniline
CID 170293885
2',7'-ditert-butyl-N-(9,9-diphenylfluoren-2-yl)-N-[2-(4-phenylphenyl)phenyl]spiro[fluorene-9,9'-xanthene]-4-amine
CID 174278515
2-[8-(3,5-ditert-butylphenyl)naphthalen-1-yl]-N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-N-[4-(3,4-diphenylphenyl)phenyl]aniline
CID 170293847
N-(9,9-diphenylfluoren-2-yl)-N-[2-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-1-amine
CID 170302496
2',7'-ditert-butyl-N-[2-(7-tert-butyl-9,9-dimethylfluoren-4-yl)phenyl]-N-(2-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 170141214
5-tert-butyl-N-(3-naphthalen-1-ylphenyl)-2-phenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170290061
N-[2-[8-(3,5-ditert-butylphenyl)naphthalen-1-yl]phenyl]-N-(9,9-diphenylfluoren-2-yl)dibenzothiophen-1-amine
CID 170302131

Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine?
The IUPAC name of N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine (CID 170292168) is N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine.
What is the SMILES notation for N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine?
The canonical SMILES for N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine is CC(C)(C)c1ccc(-c2ccccc2)c(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)c2ccccc2-c2cccc3cccc(-c4ccccc4)c23)c1.
What is the InChIKey of N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine?
The InChIKey is FVZMUDMNZYGNBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H49N/c1-62(2,3)49-38-40-51(44-22-8-4-9-23-44)60(42-49)64(59-37-19-17-33-55(59)56-35-21-27-46-26-20-34-52(61(46)56)45-24-10-5-11-25-45)50-39-41-54-53-32-16-18-36-57(53)63(58(54)43-50,47-28-12-6-13-29-47)48-30-14-7-15-31-48/h4-43H,1-3H3.
What are the key properties of N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine?
N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine has a molecular weight of 820.09 g/mol, XLogP of 16.97, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-2-phenylphenyl)-9,9-diphenyl-N-[2-(8-phenylnaphthalen-1-yl)phenyl]fluoren-2-amine is sourced from PubChem (CID 170292168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).