9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine

C96H80N2 — CID 146516645

IUPAC9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine
SMILESC=Cc1ccc(CC2(c3ccc(C(C)(C)C)cc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccc(N(c6ccc7c(c6)C(Cc6ccc(C=C)cc6)(c6ccc(C(C)(C)C)cc6)c6ccccc6-7)c6cccc7ccccc67)cc5)cc4)c4cccc5ccccc45)cc32)cc1
InChIInChI=1S/C96H80N2/c1-9-65-33-37-67(38-34-65)63-95(75-49-45-73(46-50-75)93(3,4)5)87-29-17-15-27-83(87)85-59-57-79(61-89(85)95)97(91-31-19-23-71-21-11-13-25-81(71)91)77-53-41-69(42-54-77)70-43-55-78(56-44-70)98(92-32-20-24-72-22-12-14-26-82(72)92)80-58-60-86-84-28-16-18-30-88(84)96(90(86)62-80,64-68-39-35-66(10-2)36-40-68)76-51-47-74(48-52-76)94(6,7)8/h9-62H,1-2,63-64H2,3-8H3
InChIKeyXGGDARDFSUMBGA-UHFFFAOYSA-N
MW1261.71 g/mol
LogP25.60
Rot. Bonds15

About 9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine

9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine (PubChem CID 146516645) has the molecular formula C96H80N2 and a molecular weight of 1261.71 g/mol. Its IUPAC name is 9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine.

Molecular Properties

Compound Name9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine
PubChem CID146516645
Molecular FormulaC96H80N2
Molecular Weight1261.71 g/mol
Exact Mass1260.63
IUPAC Name9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine
SMILESC=Cc1ccc(CC2(c3ccc(C(C)(C)C)cc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccc(N(c6ccc7c(c6)C(Cc6ccc(C=C)cc6)(c6ccc(C(C)(C)C)cc6)c6ccccc6-7)c6cccc7ccccc67)cc5)cc4)c4cccc5ccccc45)cc32)cc1
InChIInChI=1S/C96H80N2/c1-9-65-33-37-67(38-34-65)63-95(75-49-45-73(46-50-75)93(3,4)5)87-29-17-15-27-83(87)85-59-57-79(61-89(85)95)97(91-31-19-23-71-21-11-13-25-81(71)91)77-53-41-69(42-54-77)70-43-55-78(56-44-70)98(92-32-20-24-72-22-12-14-26-82(72)92)80-58-60-86-84-28-16-18-30-88(84)96(90(86)62-80,64-68-39-35-66(10-2)36-40-68)76-51-47-74(48-52-76)94(6,7)8/h9-62H,1-2,63-64H2,3-8H3
InChIKeyXGGDARDFSUMBGA-UHFFFAOYSA-N
XLogP25.60
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms98
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001261.71
LogP ≤ 525.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine with MolForge

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Related Compounds

2-N,2-N'-bis[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-2-N,2-N'-dinaphthalen-1-yl-9,9'-spirobi[fluorene]-2,2'-diamine;9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]naphthalen-1-yl]naphthalen-1-yl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine;9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine
CID 161297701
9-[(4-ethenylphenyl)methyl]-N-[4-[4-[4-[[9-[(4-ethenylphenyl)methyl]-9-phenylfluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]phenyl]-N-naphthalen-1-yl-9-phenylfluoren-2-amine
CID 146516715
9-(2,4-dimethylphenyl)-N-[4-[4-[4-[[9-(2,4-dimethylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine
CID 146516604
9-[(4-ethenylphenyl)methyl]-N-[4-[4-(N-[9-[(4-ethenylphenyl)methyl]-9-(4-methylphenyl)fluoren-2-yl]anilino)naphthalen-1-yl]naphthalen-1-yl]-9-(4-methylphenyl)-N-phenylfluoren-2-amine
CID 146516551
2-N,7-N-bis[9-(2,5-dimethylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-2-N,7-N,9,9-tetraphenylfluorene-2,7-diamine;2-N,7-N-bis[9-[(4-ethenylphenyl)methyl]-9-phenylfluoren-2-yl]-9,9-dimethyl-2-N,7-N-dinaphthalen-1-ylfluorene-2,7-diamine;9-[(4-ethenylphenyl)methyl]-N-[4-[4-[4-[[9-[(4-ethenylphenyl)methyl]-9-phenylfluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]phenyl]-N-naphthalen-1-yl-9-phenylfluoren-2-amine
CID 157365398
9-(4-tert-butylphenyl)-N-[4-[4-[4-(N-[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-4-phenylanilino)phenyl]-5-hexyl-2-pentylphenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 155088287
9-(4-ethenylphenyl)-N-[4-[4-[4-[[9-(4-ethenylphenyl)-9-phenylfluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]phenyl]-N-naphthalen-1-yl-9-phenylfluoren-2-amine
CID 170070824
N-[4-[9,9-bis[(4-ethenylphenyl)methyl]fluoren-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 166977720
2-N,7-N-bis[9-(2,5-dimethylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-2-N,7-N,9,9-tetraphenylfluorene-2,7-diamine;2-N,7-N-bis[9-[(4-ethenylphenyl)methyl]-9-phenylfluoren-2-yl]-9,9-diphenyl-2-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;9-[(4-ethenylphenyl)methyl]-N-[4-[4-[4-[[9-[(4-ethenylphenyl)methyl]-9-phenylfluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]phenyl]-N-naphthalen-1-yl-9-phenylfluoren-2-amine;9-[(4-ethenylphenyl)methyl]-N-[4-[4-[4-(N-[9-[(4-ethenylphenyl)methyl]-9-phenylfluoren-2-yl]-4-phenylanilino)phenyl]-2,5-dihexylphenyl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 160830965
2-N,7-N-bis(4-ethenylphenyl)-9,9-dimethyl-2-N,7-N-diphenylfluorene-2,7-diamine;4-ethenyl-N-[4-[4-(N-(4-ethenylphenyl)anilino)phenyl]phenyl]-N-phenylaniline;N-[4-[4-(4-ethenyl-N-(3-methylphenyl)anilino)phenyl]phenyl]-3-methyl-N-phenylaniline;N-[4-[4-(4-ethenyl-N-naphthalen-1-ylanilino)phenyl]phenyl]-N-(4-ethenylphenyl)naphthalen-1-amine
CID 159874682
N-[4-[4-[(E)-2-[4-[4-(4-tert-butyl-N-naphthalen-1-ylanilino)phenyl]phenyl]ethenyl]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-1-amine
CID 89068086
2-N-[9-[(4-ethenylphenyl)methyl]-9-(2,3,4,5,6-pentadeuteriocyclohexa-1,3-dien-1-yl)fluoren-2-yl]-2-N'-[9-[(4-ethenylphenyl)methyl]-9-(2,3,4,5,6-pentadeuteriophenyl)fluoren-2-yl]-2-N,2-N'-dinaphthalen-1-yl-9,9'-spirobi[fluorene]-2,2'-diamine
CID 170513489

Frequently Asked Questions

What is the IUPAC name of 9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine?
The IUPAC name of 9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine (CID 146516645) is 9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine.
What is the SMILES notation for 9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine?
The canonical SMILES for 9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine is C=Cc1ccc(CC2(c3ccc(C(C)(C)C)cc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccc(N(c6ccc7c(c6)C(Cc6ccc(C=C)cc6)(c6ccc(C(C)(C)C)cc6)c6ccccc6-7)c6cccc7ccccc67)cc5)cc4)c4cccc5ccccc45)cc32)cc1.
What is the InChIKey of 9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine?
The InChIKey is XGGDARDFSUMBGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C96H80N2/c1-9-65-33-37-67(38-34-65)63-95(75-49-45-73(46-50-75)93(3,4)5)87-29-17-15-27-83(87)85-59-57-79(61-89(85)95)97(91-31-19-23-71-21-11-13-25-81(71)91)77-53-41-69(42-54-77)70-43-55-78(56-44-70)98(92-32-20-24-72-22-12-14-26-82(72)92)80-58-60-86-84-28-16-18-30-88(84)96(90(86)62-80,64-68-39-35-66(10-2)36-40-68)76-51-47-74(48-52-76)94(6,7)8/h9-62H,1-2,63-64H2,3-8H3.
What are the key properties of 9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine?
9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine has a molecular weight of 1261.71 g/mol, XLogP of 25.60, 15 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-tert-butylphenyl)-N-[4-[4-[[9-(4-tert-butylphenyl)-9-[(4-ethenylphenyl)methyl]fluoren-2-yl]-naphthalen-1-ylamino]phenyl]phenyl]-9-[(4-ethenylphenyl)methyl]-N-naphthalen-1-ylfluoren-2-amine is sourced from PubChem (CID 146516645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).