N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline

C90H72N2 — CID 121323184

IUPACN-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline
SMILESCc1cc(-c2ccc(N(c3ccc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)c3c(C)cccc3-c3ccc4ccccc4c3)c(C)c2)ccc1N(c1ccc(-c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1)c1c(C)cccc1-c1ccc2ccccc2c1
InChIInChI=1S/C90H72N2/c1-57-19-17-27-75(71-33-31-61-21-9-11-23-65(61)53-71)87(57)91(73-43-35-63(36-44-73)69-39-47-79-77-25-13-15-29-81(77)89(5,6)83(79)55-69)85-49-41-67(51-59(85)3)68-42-50-86(60(4)52-68)92(88-58(2)20-18-28-76(88)72-34-32-62-22-10-12-24-66(62)54-72)74-45-37-64(38-46-74)70-40-48-80-78-26-14-16-30-82(78)90(7,8)84(80)56-70/h9-56H,1-8H3
InChIKeyAQCDOJXRABJEMY-UHFFFAOYSA-N
MW1181.58 g/mol
LogP25.11
Rot. Bonds11

About N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline

N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline (PubChem CID 121323184) has the molecular formula C90H72N2 and a molecular weight of 1181.58 g/mol. Its IUPAC name is N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline.

Molecular Properties

Compound NameN-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline
PubChem CID121323184
Molecular FormulaC90H72N2
Molecular Weight1181.58 g/mol
Exact Mass1180.57
IUPAC NameN-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline
SMILESCc1cc(-c2ccc(N(c3ccc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)c3c(C)cccc3-c3ccc4ccccc4c3)c(C)c2)ccc1N(c1ccc(-c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1)c1c(C)cccc1-c1ccc2ccccc2c1
InChIInChI=1S/C90H72N2/c1-57-19-17-27-75(71-33-31-61-21-9-11-23-65(61)53-71)87(57)91(73-43-35-63(36-44-73)69-39-47-79-77-25-13-15-29-81(77)89(5,6)83(79)55-69)85-49-41-67(51-59(85)3)68-42-50-86(60(4)52-68)92(88-58(2)20-18-28-76(88)72-34-32-62-22-10-12-24-66(62)54-72)74-45-37-64(38-46-74)70-40-48-80-78-26-14-16-30-82(78)90(7,8)84(80)56-70/h9-56H,1-8H3
InChIKeyAQCDOJXRABJEMY-UHFFFAOYSA-N
XLogP25.11
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms92
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001181.58
LogP ≤ 525.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline with MolForge

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Related Compounds

N-[4-[4-(N-(9,9-dimethylfluoren-2-yl)-2-naphthalen-2-ylanilino)-3-methylphenyl]-2-methylphenyl]-9,9-dimethyl-N-(2-naphthalen-2-ylphenyl)fluoren-2-amine
CID 121323170
N-(9,9-dimethylfluoren-4-yl)-9,9-dimethyl-N-(2-methyl-4-naphthalen-2-ylphenyl)fluoren-2-amine
CID 155181614
9,9-dimethyl-N-(2-methyl-4-naphthalen-2-yl-6-phenylphenyl)-N-(4-naphthalen-2-ylphenyl)fluoren-2-amine
CID 155221008
N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2,6-dimethylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2,6-dimethylaniline;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)anilino]-3-methylphenyl]-2-methyl-N-(2-phenylphenyl)aniline;N-[4-[4-(N-(2,6-dimethylphenyl)-4-triphenylen-2-ylanilino)-3-methylphenyl]-2-methylphenyl]-2,6-dimethyl-N-(4-triphenylen-2-ylphenyl)aniline;N-[4-[4-(N-(2,6-diphenylphenyl)-4-triphenylen-2-ylanilino)-3-methylphenyl]-2-methylphenyl]-2,6-diphenyl-N-(4-triphenylen-2-ylphenyl)aniline
CID 157141008
N-[4-[4-(4-dibenzofuran-4-yl-N-(2-methyl-6-naphthalen-1-ylphenyl)anilino)-3-methylphenyl]-2-methylphenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-methyl-6-naphthalen-1-ylaniline;N-[4-[4-(4-dibenzofuran-4-yl-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino)-3-methylphenyl]-2-methylphenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-methyl-6-naphthalen-2-ylaniline;4-[4-(4-dibenzofuran-4-yl-N-(2-naphthalen-1-ylphenyl)anilino)-3-methylphenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-(2-naphthalen-1-ylphenyl)aniline;4-[4-(4-dibenzofuran-4-yl-N-(2-naphthalen-2-ylphenyl)anilino)-3-methylphenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-(2-naphthalen-2-ylphenyl)aniline;2-(9,9-dimethylfluoren-2-yl)-N-[4-[4-(N-[2-(9,9-dimethylfluoren-2-yl)-6-methylphenyl]-4-methylanilino)-3-methylphenyl]-2-methylphenyl]-6-methyl-N-(4-methylphenyl)aniline;2-(9,9-dimethylfluoren-2-yl)-N-[4-[4-(N-[2-(9,9-dimethylfluoren-2-yl)-6-methylphenyl]-3-phenylanilino)-3-methylphenyl]-2-methylphenyl]-6-methyl-N-(3-phenylphenyl)aniline
CID 162140461
N-[4-(11,11-dimethylbenzo[b]fluoren-2-yl)phenyl]-9,9-dimethyl-N-(2-methylphenyl)fluoren-2-amine
CID 177080053
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-methyl-4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 155220981
7-[4-[4-[bis(9,9-dimethylfluoren-2-yl)amino]-3-naphthalen-2-ylphenyl]naphthalen-2-yl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-(2-methyl-4-naphthalen-1-yl-6-naphthalen-2-ylphenyl)fluoren-2-amine
CID 155181726
N-[4-[4-(4-dibenzothiophen-4-yl-N-[2-(9,9-dimethylfluoren-2-yl)-6-methylphenyl]anilino)-3-methylphenyl]-2-methylphenyl]-N-(4-dibenzothiophen-4-ylphenyl)-2-(9,9-dimethylfluoren-2-yl)-6-methylaniline;4-[4-(4-dibenzothiophen-4-yl-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]anilino)-3-methylphenyl]-N-(4-dibenzothiophen-4-ylphenyl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]-2-methylaniline;N-(4-dibenzothiophen-4-ylphenyl)-4-[4-(4-dibenzothiophen-4-yl-N-[2-(4-phenylphenyl)phenyl]anilino)-3-methylphenyl]-2-methyl-N-[2-(4-phenylphenyl)phenyl]aniline
CID 157469979
2-(9,9-dimethylfluoren-2-yl)-7-[7-[7-[7-[9,9-dimethyl-7-(4-naphthalen-2-ylphenyl)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 123392580
2-(9,9-dimethylfluoren-2-yl)-7-[9,9-dimethyl-7-[4-(4-naphthalen-2-ylphenyl)phenyl]fluoren-2-yl]-9,9-dimethylfluorene
CID 123709509
9,9-dimethyl-N-[4-[4-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 166565824

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline?
The IUPAC name of N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline (CID 121323184) is N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline.
What is the SMILES notation for N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline?
The canonical SMILES for N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline is Cc1cc(-c2ccc(N(c3ccc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)c3c(C)cccc3-c3ccc4ccccc4c3)c(C)c2)ccc1N(c1ccc(-c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1)c1c(C)cccc1-c1ccc2ccccc2c1.
What is the InChIKey of N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline?
The InChIKey is AQCDOJXRABJEMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C90H72N2/c1-57-19-17-27-75(71-33-31-61-21-9-11-23-65(61)53-71)87(57)91(73-43-35-63(36-44-73)69-39-47-79-77-25-13-15-29-81(77)89(5,6)83(79)55-69)85-49-41-67(51-59(85)3)68-42-50-86(60(4)52-68)92(88-58(2)20-18-28-76(88)72-34-32-62-22-10-12-24-66(62)54-72)74-45-37-64(38-46-74)70-40-48-80-78-26-14-16-30-82(78)90(7,8)84(80)56-70/h9-56H,1-8H3.
What are the key properties of N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline?
N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline has a molecular weight of 1181.58 g/mol, XLogP of 25.11, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[4-(9,9-dimethylfluoren-2-yl)-N-(2-methyl-6-naphthalen-2-ylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-methyl-6-naphthalen-2-ylaniline is sourced from PubChem (CID 121323184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).