N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine

C245H217N3O3 — CID 161387928

About N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine

N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 161387928) has the molecular formula C245H217N3O3 and a molecular weight of 3251.45 g/mol. Its IUPAC name is N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

• Compound Name: N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
• PubChem CID: 161387928
• Molecular Formula: C245H217N3O3
• Molecular Weight: 3251.45 g/mol
• Exact Mass: 3248.69
• IUPAC Name: N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
• SMILES: CCC(CC(C)c1ccc(Oc2ccc(C3(c4cc(C)cc(C)c4)c4ccccc4-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc43)cc2)cc1)c1ccc(-c2ccc3c(c2)CC3)cc1.CCC(CC(C)c1ccc(Oc2ccc(C3(c4ccc(C(C)C)cc4)c4ccccc4-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc43)cc2)cc1)c1ccc(-c2ccc3c(c2)CC3)cc1.CCCCCCc1ccc(C2(c3ccc(Oc4ccc(C(C)CC(CC)c5ccc(-c6ccc7c(c6)CC7)cc5)cc4)cc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc32)cc1
• InChI: InChI=1S/C84H77NO.C81H71NO.C80H69NO/c1-6-8-9-11-18-58-25-39-68(40-26-58)84(69-41-49-74(50-42-69)86-73-47-37-60(38-48-73)57(3)53-59(7-2)62-27-29-64(30-28-62)66-33-31-65-32-34-67(65)54-66)80-24-17-15-22-76(80)78-52-46-72(56-82(78)84)85(70-43-35-63(36-44-70)61-19-12-10-13-20-61)71-45-51-77-75-21-14-16-23-79(75)83(4,5)81(77)55-71;1-7-55(59-21-23-61(24-22-59)63-27-25-62-26-28-64(62)50-63)49-54(4)57-33-43-70(44-34-57)83-71-45-37-66(38-46-71)81(65-35-29-56(30-36-65)53(2)3)77-20-14-12-18-73(77)75-48-42-69(52-79(75)81)82(67-39-31-60(32-40-67)58-15-9-8-10-16-58)68-41-47-74-72-17-11-13-19-76(72)80(5,6)78(74)51-68;1-7-55(58-21-23-60(24-22-58)62-27-25-61-26-28-63(61)49-62)48-54(4)56-31-39-69(40-32-56)82-70-41-33-64(34-42-70)80(65-46-52(2)45-53(3)47-65)76-20-14-12-18-72(76)74-44-38-68(51-78(74)80)81(66-35-29-59(30-36-66)57-15-9-8-10-16-57)67-37-43-73-71-17-11-13-19-75(71)79(5,6)77(73)50-67/h10,12-17,19-31,33,35-52,54-57,59H,6-9,11,18,32,34,53H2,1-5H3;8-25,27,29-48,50-55H,7,26,28,49H2,1-6H3;8-25,27,29-47,49-51,54-55H,7,26,28,48H2,1-6H3
• InChIKey: VSPGBWITSOPOOV-UHFFFAOYSA-N
• XLogP: 66.08
• TPSA: 37.41 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 48
• Heavy Atoms: 251
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	3251.45
LogP ≤ 5	66.08
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-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine?

The IUPAC name of N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine (CID 161387928) is N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine.

What is the SMILES notation for N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine?

The canonical SMILES for N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine is CCC(CC(C)c1ccc(Oc2ccc(C3(c4cc(C)cc(C)c4)c4ccccc4-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc43)cc2)cc1)c1ccc(-c2ccc3c(c2)CC3)cc1.CCC(CC(C)c1ccc(Oc2ccc(C3(c4ccc(C(C)C)cc4)c4ccccc4-c4ccc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc43)cc2)cc1)c1ccc(-c2ccc3c(c2)CC3)cc1.CCCCCCc1ccc(C2(c3ccc(Oc4ccc(C(C)CC(CC)c5ccc(-c6ccc7c(c6)CC7)cc5)cc4)cc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc32)cc1.

What is the InChIKey of N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine?

The InChIKey is VSPGBWITSOPOOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H77NO.C81H71NO.C80H69NO/c1-6-8-9-11-18-58-25-39-68(40-26-58)84(69-41-49-74(50-42-69)86-73-47-37-60(38-48-73)57(3)53-59(7-2)62-27-29-64(30-28-62)66-33-31-65-32-34-67(65)54-66)80-24-17-15-22-76(80)78-52-46-72(56-82(78)84)85(70-43-35-63(36-44-70)61-19-12-10-13-20-61)71-45-51-77-75-21-14-16-23-79(75)83(4,5)81(77)55-71;1-7-55(59-21-23-61(24-22-59)63-27-25-62-26-28-64(62)50-63)49-54(4)57-33-43-70(44-34-57)83-71-45-37-66(38-46-71)81(65-35-29-56(30-36-65)53(2)3)77-20-14-12-18-73(77)75-48-42-69(52-79(75)81)82(67-39-31-60(32-40-67)58-15-9-8-10-16-58)68-41-47-74-72-17-11-13-19-76(72)80(5,6)78(74)51-68;1-7-55(58-21-23-60(24-22-58)62-27-25-61-26-28-63(61)49-62)48-54(4)56-31-39-69(40-32-56)82-70-41-33-64(34-42-70)80(65-46-52(2)45-53(3)47-65)76-20-14-12-18-72(76)74-44-38-68(51-78(74)80)81(66-35-29-59(30-36-66)57-15-9-8-10-16-57)67-37-43-73-71-17-11-13-19-75(71)79(5,6)77(73)50-67/h10,12-17,19-31,33,35-52,54-57,59H,6-9,11,18,32,34,53H2,1-5H3;8-25,27,29-48,50-55H,7,26,28,49H2,1-6H3;8-25,27,29-47,49-51,54-55H,7,26,28,48H2,1-6H3.

What are the key properties of N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine?

N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine has a molecular weight of 3251.45 g/mol, XLogP of 66.08, 48 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(3,5-dimethylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-hexylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine;N-[9-[4-[4-[4-[4-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)phenyl]hexan-2-yl]phenoxy]phenyl]-9-(4-propan-2-ylphenyl)fluoren-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 161387928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).