6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine

C110H73N3O2 — CID 158755626

About 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine

6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine (PubChem CID 158755626) has the molecular formula C110H73N3O2 and a molecular weight of 1468.81 g/mol. Its IUPAC name is 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine.

Molecular Properties

• Compound Name: 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine
• PubChem CID: 158755626
• Molecular Formula: C110H73N3O2
• Molecular Weight: 1468.81 g/mol
• Exact Mass: 1467.57
• IUPAC Name: 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine
• SMILES: c1ccc(-c2ccc(-c3c(-c4ccc(N(c5ccc6ccccc6c5)c5ccc6ccccc6c5)cc4)oc4cc5ccccc5cc34)cc2)cc1.c1ccc(-c2oc3c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4c4cc(N(c5ccccc5)c5cccc6ccccc56)ccc4c3c2-c2ccccc2)cc1
• InChI: InChI=1S/C60H40N2O.C50H33NO/c1-5-21-43(22-6-1)57-58-51-37-35-47(61(45-27-9-3-10-28-45)55-33-17-25-41-19-13-15-31-49(41)55)39-53(51)54-40-48(36-38-52(54)60(58)63-59(57)44-23-7-2-8-24-44)62(46-29-11-4-12-30-46)56-34-18-26-42-20-14-16-32-50(42)56;1-2-10-34(11-3-1)37-18-20-38(21-19-37)49-47-32-42-16-8-9-17-43(42)33-48(47)52-50(49)39-24-26-44(27-25-39)51(45-28-22-35-12-4-6-14-40(35)30-45)46-29-23-36-13-5-7-15-41(36)31-46/h1-40H;1-33H
• InChIKey: IOAPQTARYCMPNL-UHFFFAOYSA-N
• XLogP: 31.68
• TPSA: 36.00 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 14
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1468.81
LogP ≤ 5	31.68
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine?

The IUPAC name of 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine (CID 158755626) is 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine.

What is the SMILES notation for 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine?

The canonical SMILES for 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine is c1ccc(-c2ccc(-c3c(-c4ccc(N(c5ccc6ccccc6c5)c5ccc6ccccc6c5)cc4)oc4cc5ccccc5cc34)cc2)cc1.c1ccc(-c2oc3c4ccc(N(c5ccccc5)c5cccc6ccccc56)cc4c4cc(N(c5ccccc5)c5cccc6ccccc56)ccc4c3c2-c2ccccc2)cc1.

What is the InChIKey of 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine?

The InChIKey is IOAPQTARYCMPNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N2O.C50H33NO/c1-5-21-43(22-6-1)57-58-51-37-35-47(61(45-27-9-3-10-28-45)55-33-17-25-41-19-13-15-31-49(41)55)39-53(51)54-40-48(36-38-52(54)60(58)63-59(57)44-23-7-2-8-24-44)62(46-29-11-4-12-30-46)56-34-18-26-42-20-14-16-32-50(42)56;1-2-10-34(11-3-1)37-18-20-38(21-19-37)49-47-32-42-16-8-9-17-43(42)33-48(47)52-50(49)39-24-26-44(27-25-39)51(45-28-22-35-12-4-6-14-40(35)30-45)46-29-23-36-13-5-7-15-41(36)31-46/h1-40H;1-33H.

What are the key properties of 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine?

6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine has a molecular weight of 1468.81 g/mol, XLogP of 31.68, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 6-N,9-N-dinaphthalen-1-yl-6-N,9-N,2,3-tetraphenylphenanthro[9,10-b]furan-6,9-diamine;N-naphthalen-2-yl-N-[4-[3-(4-phenylphenyl)benzo[f][1]benzofuran-2-yl]phenyl]naphthalen-2-amine is sourced from PubChem (CID 158755626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).