N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine

C188H164N4O2 — CID 162204475

About N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine

N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine (PubChem CID 162204475) has the molecular formula C188H164N4O2 and a molecular weight of 2511.41 g/mol. Its IUPAC name is N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine.

Molecular Properties

• Compound Name: N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine
• PubChem CID: 162204475
• Molecular Formula: C188H164N4O2
• Molecular Weight: 2511.41 g/mol
• Exact Mass: 2509.29
• IUPAC Name: N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine
• SMILES: C=Cc1ccc(OCC(CC)CCCCC2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccccc4)c4ccc(-c5ccc6c(c5)c5cc(-c7ccc(C(C)(C)C)cc7)ccc5n6-c5ccc6c(c5)C(C)(C)c5cc(-c7ccc(C=C)cc7)ccc5-6)cc4)cc32)cc1.C=Cc1ccc(OCCCCCCC2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccc6c(c5)c5cc(-c7ccc(C(C)(C)C)cc7)ccc5n6-c5ccc6c(c5)C(C)(C)c5cc(-c7ccc(C=C)cc7)ccc5-6)cc4)cc32)cc1
• InChI: InChI=1S/C96H82N2O.C92H82N2O/c1-8-65-28-32-69(33-29-65)74-40-53-83-84-54-50-80(63-90(84)95(6,7)89(83)62-74)98-92-56-41-72(70-34-43-75(44-35-70)94(3,4)5)60-86(92)87-61-73(42-57-93(87)98)71-38-47-78(48-39-71)97(77-45-36-68(37-46-77)67-22-14-12-15-23-67)79-49-55-85-82-26-18-19-27-88(82)96(91(85)64-79,76-24-16-13-17-25-76)58-20-10-11-21-59-99-81-51-30-66(9-2)31-52-81;1-9-62-29-33-65(34-30-62)70-39-50-79-80-51-47-76(59-86(80)91(7,8)85(79)58-70)94-88-53-40-68(66-35-42-71(43-36-66)90(4,5)6)56-82(88)83-57-69(41-54-89(83)94)67-37-44-74(45-38-67)93(73-25-16-13-17-26-73)75-46-52-81-78-27-18-19-28-84(78)92(87(81)60-75,72-23-14-12-15-24-72)55-21-20-22-64(11-3)61-95-77-48-31-63(10-2)32-49-77/h8-9,12-19,22-57,60-64H,1-2,10-11,20-21,58-59H2,3-7H3;9-10,12-19,23-54,56-60,64H,1-2,11,20-22,55,61H2,3-8H3
• InChIKey: ZRZXNTZHWWIZOF-UHFFFAOYSA-N
• XLogP: 51.28
• TPSA: 34.80 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 38
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2511.41
LogP ≤ 5	51.28
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine?

The IUPAC name of N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine (CID 162204475) is N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine.

What is the SMILES notation for N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine?

The canonical SMILES for N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine is C=Cc1ccc(OCC(CC)CCCCC2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccccc4)c4ccc(-c5ccc6c(c5)c5cc(-c7ccc(C(C)(C)C)cc7)ccc5n6-c5ccc6c(c5)C(C)(C)c5cc(-c7ccc(C=C)cc7)ccc5-6)cc4)cc32)cc1.C=Cc1ccc(OCCCCCCC2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccc6c(c5)c5cc(-c7ccc(C(C)(C)C)cc7)ccc5n6-c5ccc6c(c5)C(C)(C)c5cc(-c7ccc(C=C)cc7)ccc5-6)cc4)cc32)cc1.

What is the InChIKey of N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine?

The InChIKey is ZRZXNTZHWWIZOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C96H82N2O.C92H82N2O/c1-8-65-28-32-69(33-29-65)74-40-53-83-84-54-50-80(63-90(84)95(6,7)89(83)62-74)98-92-56-41-72(70-34-43-75(44-35-70)94(3,4)5)60-86(92)87-61-73(42-57-93(87)98)71-38-47-78(48-39-71)97(77-45-36-68(37-46-77)67-22-14-12-15-23-67)79-49-55-85-82-26-18-19-27-88(82)96(91(85)64-79,76-24-16-13-17-25-76)58-20-10-11-21-59-99-81-51-30-66(9-2)31-52-81;1-9-62-29-33-65(34-30-62)70-39-50-79-80-51-47-76(59-86(80)91(7,8)85(79)58-70)94-88-53-40-68(66-35-42-71(43-36-66)90(4,5)6)56-82(88)83-57-69(41-54-89(83)94)67-37-44-74(45-38-67)93(73-25-16-13-17-26-73)75-46-52-81-78-27-18-19-28-84(78)92(87(81)60-75,72-23-14-12-15-24-72)55-21-20-22-64(11-3)61-95-77-48-31-63(10-2)32-49-77/h8-9,12-19,22-57,60-64H,1-2,10-11,20-21,58-59H2,3-7H3;9-10,12-19,23-54,56-60,64H,1-2,11,20-22,55,61H2,3-8H3.

What are the key properties of N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine?

N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine has a molecular weight of 2511.41 g/mol, XLogP of 51.28, 38 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[6-(4-ethenylphenoxy)hexyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[6-(4-tert-butylphenyl)-9-[7-(4-ethenylphenyl)-9,9-dimethylfluoren-2-yl]carbazol-3-yl]phenyl]-9-[5-[(4-ethenylphenoxy)methyl]heptyl]-N,9-diphenylfluoren-2-amine is sourced from PubChem (CID 162204475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).