N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine

C177H124N6OS — CID 158948861

About N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine

N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine (PubChem CID 158948861) has the molecular formula C177H124N6OS and a molecular weight of 2383.05 g/mol. Its IUPAC name is N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine.

Molecular Properties

• Compound Name: N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine
• PubChem CID: 158948861
• Molecular Formula: C177H124N6OS
• Molecular Weight: 2383.05 g/mol
• Exact Mass: 2380.96
• IUPAC Name: N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine
• SMILES: CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3cccc(-c4ccc5c6ccccc6c6ccccc6c5c4)c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3cccc(-c4cccc5c4oc4ccccc45)c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3cccc(-c4cccc5c4sc4ccccc45)c3)cc21
• InChI: InChI=1S/C63H44N2.C57H40N2O.C57H40N2S/c1-63(2)59-25-12-10-23-54(59)55-35-33-48(40-60(55)63)64(47-18-14-15-42(37-47)44-29-34-53-51-21-7-6-19-49(51)50-20-8-9-22-52(50)57(53)38-44)46-31-27-41(28-32-46)43-30-36-62-58(39-43)56-24-11-13-26-61(56)65(62)45-16-4-3-5-17-45;2*1-57(2)51-23-9-6-18-45(51)46-32-31-43(36-52(46)57)58(42-17-12-14-39(34-42)44-21-13-22-49-48-20-8-11-25-55(48)60-56(44)49)41-29-26-37(27-30-41)38-28-33-54-50(35-38)47-19-7-10-24-53(47)59(54)40-15-4-3-5-16-40/h3-40H,1-2H3;2*3-36H,1-2H3
• InChIKey: JLDYRTYEMXCOHC-UHFFFAOYSA-N
• XLogP: 49.41
• TPSA: 37.65 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 18
• Heavy Atoms: 185
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2383.05
LogP ≤ 5	49.41
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine?

The IUPAC name of N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine (CID 158948861) is N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine.

What is the SMILES notation for N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine?

The canonical SMILES for N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3cccc(-c4ccc5c6ccccc6c6ccccc6c5c4)c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3cccc(-c4cccc5c4oc4ccccc45)c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3cccc(-c4cccc5c4sc4ccccc45)c3)cc21.

What is the InChIKey of N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine?

The InChIKey is JLDYRTYEMXCOHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H44N2.C57H40N2O.C57H40N2S/c1-63(2)59-25-12-10-23-54(59)55-35-33-48(40-60(55)63)64(47-18-14-15-42(37-47)44-29-34-53-51-21-7-6-19-49(51)50-20-8-9-22-52(50)57(53)38-44)46-31-27-41(28-32-46)43-30-36-62-58(39-43)56-24-11-13-26-61(56)65(62)45-16-4-3-5-17-45;2*1-57(2)51-23-9-6-18-45(51)46-32-31-43(36-52(46)57)58(42-17-12-14-39(34-42)44-21-13-22-49-48-20-8-11-25-55(48)60-56(44)49)41-29-26-37(27-30-41)38-28-33-54-50(35-38)47-19-7-10-24-53(47)59(54)40-15-4-3-5-16-40/h3-40H,1-2H3;2*3-36H,1-2H3.

What are the key properties of N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine?

N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine has a molecular weight of 2383.05 g/mol, XLogP of 49.41, 18 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine is sourced from PubChem (CID 158948861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).