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

C90H60F4N2O2 — CID 169295042

About 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

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 (PubChem CID 169295042) has the molecular formula C90H60F4N2O2 and a molecular weight of 1277.47 g/mol. Its IUPAC name is 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.

Molecular Properties

• Compound Name: 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
• PubChem CID: 169295042
• Molecular Formula: C90H60F4N2O2
• Molecular Weight: 1277.47 g/mol
• Exact Mass: 1276.46
• IUPAC Name: 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
• SMILES: C=Cc1ccc(Oc2ccc(C3(c4cccc(F)c4)c4ccccc4-c4ccc(N(c5ccc(-c6ccc(N(c7cccc(F)c7)c7ccc8c(c7)C(c7ccc(Oc9ccc(C=C)cc9)cc7)(c7cccc(F)c7)c7ccccc7-8)cc6)cc5)c5cccc(F)c5)cc43)cc2)cc1
• InChI: InChI=1S/C90H60F4N2O2/c1-3-59-25-43-77(44-26-59)97-79-47-33-63(34-48-79)89(65-13-9-15-67(91)53-65)85-23-7-5-21-81(85)83-51-41-75(57-87(83)89)95(73-19-11-17-69(93)55-73)71-37-29-61(30-38-71)62-31-39-72(40-32-62)96(74-20-12-18-70(94)56-74)76-42-52-84-82-22-6-8-24-86(82)90(88(84)58-76,66-14-10-16-68(92)54-66)64-35-49-80(50-36-64)98-78-45-27-60(4-2)28-46-78/h3-58H,1-2H2
• InChIKey: HQEUWKZRQVUTFJ-UHFFFAOYSA-N
• XLogP: 24.45
• TPSA: 24.94 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 17
• Heavy Atoms: 98
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1277.47
LogP ≤ 5	24.45
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 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?

The IUPAC name of 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) is 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.

What is the SMILES notation for 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?

The canonical SMILES for 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 is C=Cc1ccc(Oc2ccc(C3(c4cccc(F)c4)c4ccccc4-c4ccc(N(c5ccc(-c6ccc(N(c7cccc(F)c7)c7ccc8c(c7)C(c7ccc(Oc9ccc(C=C)cc9)cc7)(c7cccc(F)c7)c7ccccc7-8)cc6)cc5)c5cccc(F)c5)cc43)cc2)cc1.

What is the InChIKey of 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?

The InChIKey is HQEUWKZRQVUTFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C90H60F4N2O2/c1-3-59-25-43-77(44-26-59)97-79-47-33-63(34-48-79)89(65-13-9-15-67(91)53-65)85-23-7-5-21-81(85)83-51-41-75(57-87(83)89)95(73-19-11-17-69(93)55-73)71-37-29-61(30-38-71)62-31-39-72(40-32-62)96(74-20-12-18-70(94)56-74)76-42-52-84-82-22-6-8-24-86(82)90(88(84)58-76,66-14-10-16-68(92)54-66)64-35-49-80(50-36-64)98-78-45-27-60(4-2)28-46-78/h3-58H,1-2H2.

What are the key properties of 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?

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 has a molecular weight of 1277.47 g/mol, XLogP of 24.45, 17 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 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 is sourced from PubChem (CID 169295042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).