N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine

C179H122N6O3 — CID 158215845

About N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine

N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine (PubChem CID 158215845) has the molecular formula C179H122N6O3 and a molecular weight of 2404.98 g/mol. Its IUPAC name is N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine.

Molecular Properties

• Compound Name: N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine
• PubChem CID: 158215845
• Molecular Formula: C179H122N6O3
• Molecular Weight: 2404.98 g/mol
• Exact Mass: 2402.96
• IUPAC Name: N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine
• SMILES: Cc1ccc2c(c1)c1cc(-c3ccc(N(c4ccc(-c5cccc6c5oc5ccccc56)cc4)c4ccc5c6ccccc6c6ccccc6c5c4)cc3)ccc1n2-c1ccccc1.Cc1cccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc(-c6cccc7c6oc6ccccc67)cc5)c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4)ccc32)c1.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(-c5ccc(N(c6ccccc6)c6ccc(-c7cccc8c7oc7ccccc78)cc6)cc5)ccc43)c2)cc1
• InChI: InChI=1S/C61H40N2O.C60H40N2O.C58H42N2O/c1-39-22-34-58-56(36-39)57-37-42(27-35-59(57)63(58)43-12-3-2-4-13-43)40-23-28-44(29-24-40)62(46-32-33-52-50-16-6-5-14-48(50)49-15-7-8-17-51(49)55(52)38-46)45-30-25-41(26-31-45)47-19-11-20-54-53-18-9-10-21-60(53)64-61(47)54;1-4-15-41(16-5-1)46-37-47(42-17-6-2-7-18-42)39-51(38-46)62-57-25-12-10-21-53(57)56-40-45(31-36-58(56)62)43-27-32-49(33-28-43)61(48-19-8-3-9-20-48)50-34-29-44(30-35-50)52-23-14-24-55-54-22-11-13-26-59(54)63-60(52)55;1-37-12-10-13-43(34-37)60-54-20-8-5-15-48(54)51-35-40(26-33-55(51)60)38-22-27-41(28-23-38)59(44-31-32-47-46-14-4-7-19-52(46)58(2,3)53(47)36-44)42-29-24-39(25-30-42)45-17-11-18-50-49-16-6-9-21-56(49)61-57(45)50/h2-38H,1H3;1-40H;4-36H,1-3H3
• InChIKey: GCQBSZQMVUOHST-UHFFFAOYSA-N
• XLogP: 50.18
• TPSA: 63.93 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 20
• Heavy Atoms: 188
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2404.98
LogP ≤ 5	50.18
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine?

The IUPAC name of N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine (CID 158215845) is N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine.

What is the SMILES notation for N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine?

The canonical SMILES for N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine is Cc1ccc2c(c1)c1cc(-c3ccc(N(c4ccc(-c5cccc6c5oc5ccccc56)cc4)c4ccc5c6ccccc6c6ccccc6c5c4)cc3)ccc1n2-c1ccccc1.Cc1cccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc(-c6cccc7c6oc6ccccc67)cc5)c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4)ccc32)c1.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(-c5ccc(N(c6ccccc6)c6ccc(-c7cccc8c7oc7ccccc78)cc6)cc5)ccc43)c2)cc1.

What is the InChIKey of N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine?

The InChIKey is GCQBSZQMVUOHST-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H40N2O.C60H40N2O.C58H42N2O/c1-39-22-34-58-56(36-39)57-37-42(27-35-59(57)63(58)43-12-3-2-4-13-43)40-23-28-44(29-24-40)62(46-32-33-52-50-16-6-5-14-48(50)49-15-7-8-17-51(49)55(52)38-46)45-30-25-41(26-31-45)47-19-11-20-54-53-18-9-10-21-60(53)64-61(47)54;1-4-15-41(16-5-1)46-37-47(42-17-6-2-7-18-42)39-51(38-46)62-57-25-12-10-21-53(57)56-40-45(31-36-58(56)62)43-27-32-49(33-28-43)61(48-19-8-3-9-20-48)50-34-29-44(30-35-50)52-23-14-24-55-54-22-11-13-26-59(54)63-60(52)55;1-37-12-10-13-43(34-37)60-54-20-8-5-15-48(54)51-35-40(26-33-55(51)60)38-22-27-41(28-23-38)59(44-31-32-47-46-14-4-7-19-52(46)58(2,3)53(47)36-44)42-29-24-39(25-30-42)45-17-11-18-50-49-16-6-9-21-56(49)61-57(45)50/h2-38H,1H3;1-40H;4-36H,1-3H3.

What are the key properties of N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine?

N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine has a molecular weight of 2404.98 g/mol, XLogP of 50.18, 20 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-[9-(3-methylphenyl)carbazol-3-yl]phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-4-[9-(3,5-diphenylphenyl)carbazol-3-yl]-N-phenylaniline;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(6-methyl-9-phenylcarbazol-3-yl)phenyl]triphenylen-2-amine is sourced from PubChem (CID 158215845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).