2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline

C84H64N2 — CID 121323106

IUPAC2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline
SMILESCc1cc(-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3c(C)cccc3-c3cccc4ccccc34)c(C)c2)ccc1N(c1ccc(-c2cccc(-c3ccccc3)c2)cc1)c1c(C)cccc1-c1cccc2ccccc12
InChIInChI=1S/C84H64N2/c1-57-21-15-39-79(77-37-19-29-65-27-11-13-35-75(65)77)83(57)85(73-47-41-63(42-48-73)69-33-17-31-67(55-69)61-23-7-5-8-24-61)81-51-45-71(53-59(81)3)72-46-52-82(60(4)54-72)86(84-58(2)22-16-40-80(84)78-38-20-30-66-28-12-14-36-76(66)78)74-49-43-64(44-50-74)70-34-18-32-68(56-70)62-25-9-6-10-26-62/h5-56H,1-4H3
InChIKeyYEJGFJQRENSUAT-UHFFFAOYSA-N
MW1101.45 g/mol
LogP23.84
Rot. Bonds13

About 2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline

2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline (PubChem CID 121323106) has the molecular formula C84H64N2 and a molecular weight of 1101.45 g/mol. Its IUPAC name is 2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline.

Molecular Properties

Compound Name2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline
PubChem CID121323106
Molecular FormulaC84H64N2
Molecular Weight1101.45 g/mol
Exact Mass1100.51
IUPAC Name2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline
SMILESCc1cc(-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3c(C)cccc3-c3cccc4ccccc34)c(C)c2)ccc1N(c1ccc(-c2cccc(-c3ccccc3)c2)cc1)c1c(C)cccc1-c1cccc2ccccc12
InChIInChI=1S/C84H64N2/c1-57-21-15-39-79(77-37-19-29-65-27-11-13-35-75(65)77)83(57)85(73-47-41-63(42-48-73)69-33-17-31-67(55-69)61-23-7-5-8-24-61)81-51-45-71(53-59(81)3)72-46-52-82(60(4)54-72)86(84-58(2)22-16-40-80(84)78-38-20-30-66-28-12-14-36-76(66)78)74-49-43-64(44-50-74)70-34-18-32-68(56-70)62-25-9-6-10-26-62/h5-56H,1-4H3
InChIKeyYEJGFJQRENSUAT-UHFFFAOYSA-N
XLogP23.84
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms86
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001101.45
LogP ≤ 523.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline with MolForge

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Related Compounds

2-methyl-N-[2-methyl-4-[3-methyl-4-(N-(2-methyl-6-naphthalen-1-ylphenyl)-4-phenylanilino)phenyl]phenyl]-6-naphthalen-1-yl-N-(4-phenylphenyl)aniline
CID 121323094
2-methyl-N-[2-methyl-4-[3-methyl-4-[N-[2-methyl-6-(4-phenylphenyl)phenyl]-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 121322983
2-methyl-N-[4-[4-[N-(2-methylphenyl)-4-(4-phenylphenyl)anilino]phenyl]phenyl]-4-naphthalen-1-yl-N-phenylaniline
CID 59469991
2-dibenzothiophen-2-yl-N-[4-[4-[N-(2-dibenzothiophen-2-yl-6-methylphenyl)-4-(4-phenylphenyl)anilino]-3-methylphenyl]-2-methylphenyl]-6-methyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 121323372
N-[4-[4-(4-dibenzofuran-4-yl-N-[2-methyl-6-(4-phenylphenyl)phenyl]anilino)-3-methylphenyl]-2-methylphenyl]-N-(4-dibenzofuran-4-ylphenyl)-2-methyl-6-(4-phenylphenyl)aniline
CID 121323023
N-[4-[4-(N-(2,6-diphenylphenyl)anilino)-3-methylphenyl]-2-methylphenyl]-N,2,6-triphenylaniline
CID 121322665
4-[3,5-dimethyl-4-(4-naphthalen-1-yl-N-(2-phenylphenyl)anilino)phenyl]-2,6-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(2-phenylphenyl)aniline
CID 121322882
N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline
CID 155119854
2-methyl-4-phenyl-N,N-bis(4-phenylphenyl)aniline
CID 90277832
2-dibenzofuran-2-yl-N-[4-[4-(N-(2-dibenzofuran-2-yl-6-methylphenyl)-4-naphthalen-2-ylanilino)-3-methylphenyl]-2-methylphenyl]-6-methyl-N-(4-naphthalen-2-ylphenyl)aniline
CID 121323318
N-[4-[4-(N,4-dinaphthalen-1-ylanilino)phenyl]phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine
CID 59861426
N-[4-[4-(2-dibenzothiophen-4-yl-6-methyl-N-naphthalen-1-ylanilino)-3-methylphenyl]-2-methylphenyl]-N-(2-dibenzothiophen-4-yl-6-methylphenyl)naphthalen-1-amine
CID 121323241

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline?
The IUPAC name of 2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline (CID 121323106) is 2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline.
What is the SMILES notation for 2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline?
The canonical SMILES for 2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline is Cc1cc(-c2ccc(N(c3ccc(-c4cccc(-c5ccccc5)c4)cc3)c3c(C)cccc3-c3cccc4ccccc34)c(C)c2)ccc1N(c1ccc(-c2cccc(-c3ccccc3)c2)cc1)c1c(C)cccc1-c1cccc2ccccc12.
What is the InChIKey of 2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline?
The InChIKey is YEJGFJQRENSUAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H64N2/c1-57-21-15-39-79(77-37-19-29-65-27-11-13-35-75(65)77)83(57)85(73-47-41-63(42-48-73)69-33-17-31-67(55-69)61-23-7-5-8-24-61)81-51-45-71(53-59(81)3)72-46-52-82(60(4)54-72)86(84-58(2)22-16-40-80(84)78-38-20-30-66-28-12-14-36-76(66)78)74-49-43-64(44-50-74)70-34-18-32-68(56-70)62-25-9-6-10-26-62/h5-56H,1-4H3.
What are the key properties of 2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline?
2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline has a molecular weight of 1101.45 g/mol, XLogP of 23.84, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-methyl-4-[3-methyl-4-[N-(2-methyl-6-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)anilino]phenyl]phenyl]-6-naphthalen-1-yl-N-[4-(3-phenylphenyl)phenyl]aniline is sourced from PubChem (CID 121323106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).