N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine

C87H61F2NO2 — CID 169286424

IUPACN-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine
SMILESC=Cc1ccc(Oc2ccc(C3(c4ccc(F)cc4)c4ccccc4-c4ccc(N(c5ccc(-c6cccc7c6C(C)(C)c6ccccc6-7)cc5)c5ccc6c(c5)C(c5ccc(F)cc5)(c5ccc(Oc7ccc(C=C)cc7)cc5)c5ccccc5-6)cc43)cc2)cc1
InChIInChI=1S/C87H61F2NO2/c1-5-56-22-44-68(45-23-56)91-70-48-32-61(33-49-70)86(59-28-36-63(88)37-29-59)80-20-11-8-14-73(80)76-52-42-66(54-82(76)86)90(65-40-26-58(27-41-65)72-17-13-18-78-75-16-7-10-19-79(75)85(3,4)84(72)78)67-43-53-77-74-15-9-12-21-81(74)87(83(77)55-67,60-30-38-64(89)39-31-60)62-34-50-71(51-35-62)92-69-46-24-57(6-2)25-47-69/h5-55H,1-2H2,3-4H3
InChIKeyYIZJUTJAPHMNKG-UHFFFAOYSA-N
MW1190.45 g/mol
LogP23.00
Rot. Bonds14

About N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine

N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine (PubChem CID 169286424) has the molecular formula C87H61F2NO2 and a molecular weight of 1190.45 g/mol. Its IUPAC name is N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine.

Molecular Properties

Compound NameN-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine
PubChem CID169286424
Molecular FormulaC87H61F2NO2
Molecular Weight1190.45 g/mol
Exact Mass1189.47
IUPAC NameN-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine
SMILESC=Cc1ccc(Oc2ccc(C3(c4ccc(F)cc4)c4ccccc4-c4ccc(N(c5ccc(-c6cccc7c6C(C)(C)c6ccccc6-7)cc5)c5ccc6c(c5)C(c5ccc(F)cc5)(c5ccc(Oc7ccc(C=C)cc7)cc5)c5ccccc5-6)cc43)cc2)cc1
InChIInChI=1S/C87H61F2NO2/c1-5-56-22-44-68(45-23-56)91-70-48-32-61(33-49-70)86(59-28-36-63(88)37-29-59)80-20-11-8-14-73(80)76-52-42-66(54-82(76)86)90(65-40-26-58(27-41-65)72-17-13-18-78-75-16-7-10-19-79(75)85(3,4)84(72)78)67-43-53-77-74-15-9-12-21-81(74)87(83(77)55-67,60-30-38-64(89)39-31-60)62-34-50-71(51-35-62)92-69-46-24-57(6-2)25-47-69/h5-55H,1-2H2,3-4H3
InChIKeyYIZJUTJAPHMNKG-UHFFFAOYSA-N
XLogP23.00
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms92
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001190.45
LogP ≤ 523.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine?
The IUPAC name of N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine (CID 169286424) is N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine.
What is the SMILES notation for N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine?
The canonical SMILES for N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine is C=Cc1ccc(Oc2ccc(C3(c4ccc(F)cc4)c4ccccc4-c4ccc(N(c5ccc(-c6cccc7c6C(C)(C)c6ccccc6-7)cc5)c5ccc6c(c5)C(c5ccc(F)cc5)(c5ccc(Oc7ccc(C=C)cc7)cc5)c5ccccc5-6)cc43)cc2)cc1.
What is the InChIKey of N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine?
The InChIKey is YIZJUTJAPHMNKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C87H61F2NO2/c1-5-56-22-44-68(45-23-56)91-70-48-32-61(33-49-70)86(59-28-36-63(88)37-29-59)80-20-11-8-14-73(80)76-52-42-66(54-82(76)86)90(65-40-26-58(27-41-65)72-17-13-18-78-75-16-7-10-19-79(75)85(3,4)84(72)78)67-43-53-77-74-15-9-12-21-81(74)87(83(77)55-67,60-30-38-64(89)39-31-60)62-34-50-71(51-35-62)92-69-46-24-57(6-2)25-47-69/h5-55H,1-2H2,3-4H3.
What are the key properties of N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine?
N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine has a molecular weight of 1190.45 g/mol, XLogP of 23.00, 14 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(9,9-dimethylfluoren-1-yl)phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-9-(4-fluorophenyl)fluoren-2-amine is sourced from PubChem (CID 169286424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).