9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine

C66H44F3N — CID 170541554

IUPAC9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine
SMILESC=Cc1ccc(C2(c3cccc(F)c3)c3ccccc3-c3ccc(N(c4ccc(-c5ccc(F)cc5)cc4)c4ccc5c(c4)C(c4ccc(C=C)cc4)(c4cccc(F)c4)c4ccccc4-5)cc32)cc1
InChIInChI=1S/C66H44F3N/c1-3-43-19-27-47(28-20-43)65(49-11-9-13-52(68)39-49)61-17-7-5-15-57(61)59-37-35-55(41-63(59)65)70(54-33-25-46(26-34-54)45-23-31-51(67)32-24-45)56-36-38-60-58-16-6-8-18-62(58)66(64(60)42-56,50-12-10-14-53(69)40-50)48-29-21-44(4-2)22-30-48/h3-42H,1-2H2
InChIKeyYGZPOGPLRGSKTC-UHFFFAOYSA-N
MW908.08 g/mol
LogP17.25
Rot. Bonds10

About 9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine

9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine (PubChem CID 170541554) has the molecular formula C66H44F3N and a molecular weight of 908.08 g/mol. Its IUPAC name is 9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine.

Molecular Properties

Compound Name9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine
PubChem CID170541554
Molecular FormulaC66H44F3N
Molecular Weight908.08 g/mol
Exact Mass907.34
IUPAC Name9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine
SMILESC=Cc1ccc(C2(c3cccc(F)c3)c3ccccc3-c3ccc(N(c4ccc(-c5ccc(F)cc5)cc4)c4ccc5c(c4)C(c4ccc(C=C)cc4)(c4cccc(F)c4)c4ccccc4-5)cc32)cc1
InChIInChI=1S/C66H44F3N/c1-3-43-19-27-47(28-20-43)65(49-11-9-13-52(68)39-49)61-17-7-5-15-57(61)59-37-35-55(41-63(59)65)70(54-33-25-46(26-34-54)45-23-31-51(67)32-24-45)56-36-38-60-58-16-6-8-18-62(58)66(64(60)42-56,50-12-10-14-53(69)40-50)48-29-21-44(4-2)22-30-48/h3-42H,1-2H2
InChIKeyYGZPOGPLRGSKTC-UHFFFAOYSA-N
XLogP17.25
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500908.08
LogP ≤ 517.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-N,7-N-bis[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(3-fluorophenyl)fluoren-2-yl]anilino)phenyl]phenyl]-2-N,7-N,9,9-tetraphenylfluorene-2,7-diamine
CID 172547070
9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(3-fluorophenyl)fluoren-2-yl]-3-fluoroanilino)phenyl]phenyl]-N,9-bis(3-fluorophenyl)fluoren-2-amine
CID 169295042
9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-(N-[3-[9-[3-(N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-phenylfluoren-2-yl]-4-fluoroanilino)phenyl]phenyl]anilino)phenyl]fluoren-9-yl]phenyl]anilino)phenyl]phenyl]-N,9-diphenylfluoren-2-amine
CID 172547054
9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-phenylfluoren-2-yl]-4-fluoroanilino)phenyl]phenyl]-N-(4-fluorophenyl)-9-phenylfluoren-2-amine
CID 166686283
9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[4-[4-[9-[4-[4-[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(4-fluorophenyl)fluoren-2-yl]-4-fluoroanilino)phenyl]phenyl]-N-(4-fluorophenyl)anilino]phenyl]fluoren-9-yl]-N-(4-fluorophenyl)anilino]phenyl]phenyl]phenyl]-N,9-bis(4-fluorophenyl)fluoren-2-amine
CID 172547006
2-N,7-N-bis[4-(N-[9-(4-ethenylphenyl)-9-(4-fluorophenyl)fluoren-2-yl]-4-phenylanilino)phenyl]-2-N,7-N-bis(4-fluorophenyl)-9,9-dimethylfluorene-2,7-diamine
CID 172546940
9-(4-ethenylphenyl)-N-[4-[4-(N-[9-(4-ethenylphenyl)-9-(4-fluorophenyl)fluoren-2-yl]-4-fluoro-3-methylanilino)phenyl]phenyl]-N-(4-fluoro-3-methylphenyl)-9-(4-fluorophenyl)fluoren-2-amine
CID 163500868
9-(3,4-difluorophenyl)-N-[4-[4-(N-[9-(3,4-difluorophenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-4-fluoroanilino)phenyl]phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-(4-fluorophenyl)fluoren-2-amine
CID 169295027
9-(2,6-difluorophenyl)-N-[9-(2,6-difluorophenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine
CID 167160935
9-(2,6-difluorophenyl)-N-[4-[4-[N-[9-(2,6-difluorophenyl)-9-[4-(4-ethenylphenoxy)phenyl]fluoren-2-yl]-4-(4-fluorophenyl)anilino]phenyl]phenyl]-9-[4-(4-ethenylphenoxy)phenyl]-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine
CID 169294879
9-[4-(4-ethenylphenoxy)phenyl]-N-[4-[4-[N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,4,5,6-pentafluorophenyl)fluoren-2-yl]-4-(4-fluorophenyl)anilino]phenyl]phenyl]-N-[4-(4-fluorophenyl)phenyl]-9-(2,3,4,5,6-pentafluorophenyl)fluoren-2-amine
CID 169294903
3-N,7-N-bis[4-[4-(N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(3-fluorophenyl)fluoren-2-yl]-4-phenylanilino)phenyl]phenyl]-3-N,7-N-bis(4-phenylphenyl)dibenzofuran-3,7-diamine
CID 172546982

Frequently Asked Questions

What is the IUPAC name of 9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine?
The IUPAC name of 9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine (CID 170541554) is 9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine.
What is the SMILES notation for 9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine?
The canonical SMILES for 9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine is C=Cc1ccc(C2(c3cccc(F)c3)c3ccccc3-c3ccc(N(c4ccc(-c5ccc(F)cc5)cc4)c4ccc5c(c4)C(c4ccc(C=C)cc4)(c4cccc(F)c4)c4ccccc4-5)cc32)cc1.
What is the InChIKey of 9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine?
The InChIKey is YGZPOGPLRGSKTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H44F3N/c1-3-43-19-27-47(28-20-43)65(49-11-9-13-52(68)39-49)61-17-7-5-15-57(61)59-37-35-55(41-63(59)65)70(54-33-25-46(26-34-54)45-23-31-51(67)32-24-45)56-36-38-60-58-16-6-8-18-62(58)66(64(60)42-56,50-12-10-14-53(69)40-50)48-29-21-44(4-2)22-30-48/h3-42H,1-2H2.
What are the key properties of 9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine?
9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine has a molecular weight of 908.08 g/mol, XLogP of 17.25, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-ethenylphenyl)-N-[9-(4-ethenylphenyl)-9-(3-fluorophenyl)fluoren-2-yl]-9-(3-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]fluoren-2-amine is sourced from PubChem (CID 170541554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).