4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline

C147H100F8N6 — CID 159084077

About 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline

4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline (PubChem CID 159084077) has the molecular formula C147H100F8N6 and a molecular weight of 2102.44 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline.

Molecular Properties

• Compound Name: 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline
• PubChem CID: 159084077
• Molecular Formula: C147H100F8N6
• Molecular Weight: 2102.44 g/mol
• Exact Mass: 2100.79
• IUPAC Name: 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline
• SMILES: Cc1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6c(F)c(F)c(F)c(F)c6F)cc5)cc4)ccc32)cc1.Cc1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccc(F)cc6)cc5)cc4)ccc32)cc1.Cc1ccc2c(c1)c1cc(-c3ccc(N(c4ccc(-c5ccc(F)cc5)cc4)c4ccc(-c5ccc(F)cc5)cc4)cc3)ccc1n2-c1ccccc1
• InChI: InChI=1S/C49H31F5N2.C49H34F2N2.C49H35FN2/c1-30-11-20-39(21-12-30)56-42-10-6-5-9-40(42)41-29-35(19-28-43(41)56)33-15-24-37(25-16-33)55(36-22-13-32(14-23-36)31-7-3-2-4-8-31)38-26-17-34(18-27-38)44-45(50)47(52)49(54)48(53)46(44)51;1-33-7-29-48-46(31-33)47-32-39(18-30-49(47)53(48)42-5-3-2-4-6-42)38-16-27-45(28-17-38)52(43-23-12-36(13-24-43)34-8-19-40(50)20-9-34)44-25-14-37(15-26-44)35-10-21-41(51)22-11-35;1-34-11-24-45(25-12-34)52-48-10-6-5-9-46(48)47-33-40(21-32-49(47)52)39-19-30-44(31-20-39)51(42-26-15-37(16-27-42)35-7-3-2-4-8-35)43-28-17-38(18-29-43)36-13-22-41(50)23-14-36/h2-29H,1H3;2-32H,1H3;2-33H,1H3
• InChIKey: KBFITLODJNRSAW-UHFFFAOYSA-N
• XLogP: 41.80
• TPSA: 24.51 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 21
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2102.44
LogP ≤ 5	41.80
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline?

The IUPAC name of 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline (CID 159084077) is 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline.

What is the SMILES notation for 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline?

The canonical SMILES for 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline is Cc1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6c(F)c(F)c(F)c(F)c6F)cc5)cc4)ccc32)cc1.Cc1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccc(F)cc6)cc5)cc4)ccc32)cc1.Cc1ccc2c(c1)c1cc(-c3ccc(N(c4ccc(-c5ccc(F)cc5)cc4)c4ccc(-c5ccc(F)cc5)cc4)cc3)ccc1n2-c1ccccc1.

What is the InChIKey of 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline?

The InChIKey is KBFITLODJNRSAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H31F5N2.C49H34F2N2.C49H35FN2/c1-30-11-20-39(21-12-30)56-42-10-6-5-9-40(42)41-29-35(19-28-43(41)56)33-15-24-37(25-16-33)55(36-22-13-32(14-23-36)31-7-3-2-4-8-31)38-26-17-34(18-27-38)44-45(50)47(52)49(54)48(53)46(44)51;1-33-7-29-48-46(31-33)47-32-39(18-30-49(47)53(48)42-5-3-2-4-6-42)38-16-27-45(28-17-38)52(43-23-12-36(13-24-43)34-8-19-40(50)20-9-34)44-25-14-37(15-26-44)35-10-21-41(51)22-11-35;1-34-11-24-45(25-12-34)52-48-10-6-5-9-46(48)47-33-40(21-32-49(47)52)39-19-30-44(31-20-39)51(42-26-15-37(16-27-42)35-7-3-2-4-8-35)43-28-17-38(18-29-43)36-13-22-41(50)23-14-36/h2-29H,1H3;2-32H,1H3;2-33H,1H3.

What are the key properties of 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline?

4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline has a molecular weight of 2102.44 g/mol, XLogP of 41.80, 21 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(4-fluorophenyl)-N-[4-(4-fluorophenyl)phenyl]-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]aniline;N-[4-(4-fluorophenyl)phenyl]-N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-4-phenylaniline;N-[4-[9-(4-methylphenyl)carbazol-3-yl]phenyl]-N-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]-4-phenylaniline is sourced from PubChem (CID 159084077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).