N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine

C128H88N4 — CID 159307358

About N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine

N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine (PubChem CID 159307358) has the molecular formula C128H88N4 and a molecular weight of 1682.14 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine.

Molecular Properties

• Compound Name: N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine
• PubChem CID: 159307358
• Molecular Formula: C128H88N4
• Molecular Weight: 1682.14 g/mol
• Exact Mass: 1680.70
• IUPAC Name: N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine
• SMILES: CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4c5ccccc5c5ccccc5c4c3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4ccccc34)cc21
• InChI: InChI=1S/C67H46N2.C61H42N2/c1-67(2)62-26-14-12-23-56(62)57-36-34-48(42-63(57)67)68(47-32-28-43(29-33-47)44-30-35-55-53-21-7-6-19-51(53)52-20-8-9-22-54(52)60(55)40-44)65-39-37-49(50-18-10-11-24-58(50)65)45-31-38-66-61(41-45)59-25-13-15-27-64(59)69(66)46-16-4-3-5-17-46;1-61(2)56-26-14-12-23-50(56)51-32-30-42(38-57(51)61)62(41-29-31-49-47-21-7-6-19-45(47)46-20-8-9-22-48(46)54(49)37-41)59-35-33-43(44-18-10-11-24-52(44)59)39-28-34-60-55(36-39)53-25-13-15-27-58(53)63(60)40-16-4-3-5-17-40/h3-42H,1-2H3;3-38H,1-2H3
• InChIKey: LCBXAMCWIOEEMQ-UHFFFAOYSA-N
• XLogP: 35.35
• TPSA: 16.34 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 11
• Heavy Atoms: 132
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1682.14
LogP ≤ 5	35.35
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine?

The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine (CID 159307358) is N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine.

What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine?

The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4ccccc34)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4c5ccccc5c5ccccc5c4c3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4ccccc34)cc21.

What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine?

The InChIKey is LCBXAMCWIOEEMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H46N2.C61H42N2/c1-67(2)62-26-14-12-23-56(62)57-36-34-48(42-63(57)67)68(47-32-28-43(29-33-47)44-30-35-55-53-21-7-6-19-51(53)52-20-8-9-22-54(52)60(55)40-44)65-39-37-49(50-18-10-11-24-58(50)65)45-31-38-66-61(41-45)59-25-13-15-27-64(59)69(66)46-16-4-3-5-17-46;1-61(2)56-26-14-12-23-50(56)51-32-30-42(38-57(51)61)62(41-29-31-49-47-21-7-6-19-45(47)46-20-8-9-22-48(46)54(49)37-41)59-35-33-43(44-18-10-11-24-52(44)59)39-28-34-60-55(36-39)53-25-13-15-27-58(53)63(60)40-16-4-3-5-17-40/h3-42H,1-2H3;3-38H,1-2H3.

What are the key properties of N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine?

N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine has a molecular weight of 1682.14 g/mol, XLogP of 35.35, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]triphenylen-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)naphthalen-1-yl]-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine is sourced from PubChem (CID 159307358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).