N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine

C238H166N8O3Si4 — CID 165077516

About N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine

N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine (PubChem CID 165077516) has the molecular formula C238H166N8O3Si4 and a molecular weight of 3298.34 g/mol. Its IUPAC name is N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine.

Molecular Properties

• Compound Name: N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine
• PubChem CID: 165077516
• Molecular Formula: C238H166N8O3Si4
• Molecular Weight: 3298.34 g/mol
• Exact Mass: 3295.22
• IUPAC Name: N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine
• SMILES: C[Si]1(C)c2ccccc2C2(c3ccccc3-c3cccc4cccc2c34)c2ccc(N(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3cccc4oc5ccccc5c34)cc21.C[Si]1(C)c2ccccc2C2(c3ccccc3-c3cccc4cccc2c34)c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21.C[Si]1(C)c2ccccc2C2(c3ccccc3-c3cccc4cccc2c34)c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21.C[Si]1(C)c2ccccc2C2(c3ccccc3-c3cccc4cccc2c34)c2ccc(N(c3ccccc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21
• InChI: InChI=1S/3C61H42N2OSi.C55H40N2Si/c1-65(2)57-32-13-10-26-49(57)61(48-25-9-6-21-43(48)45-24-14-17-39-18-15-27-51(61)59(39)45)50-35-33-42(38-58(50)65)62(54-29-16-31-56-60(54)46-23-8-12-30-55(46)64-56)41-34-36-53-47(37-41)44-22-7-11-28-52(44)63(53)40-19-4-3-5-20-40;1-65(2)58-29-13-10-25-51(58)61(50-24-9-6-20-44(50)48-23-14-16-39-17-15-26-53(61)60(39)48)52-34-31-43(38-59(52)65)62(42-30-33-47-46-22-8-12-28-56(46)64-57(47)37-42)41-32-35-55-49(36-41)45-21-7-11-27-54(45)63(55)40-18-4-3-5-19-40;1-65(2)58-29-13-10-25-51(58)61(50-24-9-6-20-44(50)47-23-14-16-39-17-15-26-53(61)60(39)47)52-33-30-43(38-59(52)65)62(42-32-35-57-49(37-42)46-22-8-12-28-56(46)64-57)41-31-34-55-48(36-41)45-21-7-11-27-54(45)63(55)40-18-4-3-5-19-40;1-58(2)52-30-14-12-27-47(52)55(46-26-11-9-23-42(46)44-25-15-17-37-18-16-28-49(55)54(37)44)48-33-31-41(36-53(48)58)56(38-19-5-3-6-20-38)40-32-34-51-45(35-40)43-24-10-13-29-50(43)57(51)39-21-7-4-8-22-39/h3*3-38H,1-2H3;3-36H,1-2H3
• InChIKey: UOGHENUMMGAJMJ-UHFFFAOYSA-N
• XLogP: 57.32
• TPSA: 72.10 Ų
• H-Bond Acceptors: 11
• Rotatable Bonds: 16
• Heavy Atoms: 253
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3298.34
LogP ≤ 5	57.32
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine?

The IUPAC name of N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine (CID 165077516) is N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine.

What is the SMILES notation for N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine?

The canonical SMILES for N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine is C[Si]1(C)c2ccccc2C2(c3ccccc3-c3cccc4cccc2c34)c2ccc(N(c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3cccc4oc5ccccc5c34)cc21.C[Si]1(C)c2ccccc2C2(c3ccccc3-c3cccc4cccc2c34)c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21.C[Si]1(C)c2ccccc2C2(c3ccccc3-c3cccc4cccc2c34)c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21.C[Si]1(C)c2ccccc2C2(c3ccccc3-c3cccc4cccc2c34)c2ccc(N(c3ccccc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21.

What is the InChIKey of N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine?

The InChIKey is UOGHENUMMGAJMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C61H42N2OSi.C55H40N2Si/c1-65(2)57-32-13-10-26-49(57)61(48-25-9-6-21-43(48)45-24-14-17-39-18-15-27-51(61)59(39)45)50-35-33-42(38-58(50)65)62(54-29-16-31-56-60(54)46-23-8-12-30-55(46)64-56)41-34-36-53-47(37-41)44-22-7-11-28-52(44)63(53)40-19-4-3-5-20-40;1-65(2)58-29-13-10-25-51(58)61(50-24-9-6-20-44(50)48-23-14-16-39-17-15-26-53(61)60(39)48)52-34-31-43(38-59(52)65)62(42-30-33-47-46-22-8-12-28-56(46)64-57(47)37-42)41-32-35-55-49(36-41)45-21-7-11-27-54(45)63(55)40-18-4-3-5-19-40;1-65(2)58-29-13-10-25-51(58)61(50-24-9-6-20-44(50)47-23-14-16-39-17-15-26-53(61)60(39)47)52-33-30-43(38-59(52)65)62(42-32-35-57-49(37-42)46-22-8-12-28-56(46)64-57)41-31-34-55-48(36-41)45-21-7-11-27-54(45)63(55)40-18-4-3-5-19-40;1-58(2)52-30-14-12-27-47(52)55(46-26-11-9-23-42(46)44-25-15-17-37-18-16-28-49(55)54(37)44)48-33-31-41(36-53(48)58)56(38-19-5-3-6-20-38)40-32-34-51-45(35-40)43-24-10-13-29-50(43)57(51)39-21-7-4-8-22-39/h3*3-38H,1-2H3;3-36H,1-2H3.

What are the key properties of N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine?

N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine has a molecular weight of 3298.34 g/mol, XLogP of 57.32, 16 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for N-dibenzofuran-1-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-2-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-dibenzofuran-3-yl-N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-9-phenylcarbazol-3-amine;N-(5',5'-dimethylspiro[benzo[a]phenalene-7,10'-benzo[b][1]benzosiline]-3'-yl)-N,9-diphenylcarbazol-3-amine is sourced from PubChem (CID 165077516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).