N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine

C211H130N8O7 — CID 160757980

About N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine

N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine (PubChem CID 160757980) has the molecular formula C211H130N8O7 and a molecular weight of 2889.41 g/mol. Its IUPAC name is N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine.

Molecular Properties

• Compound Name: N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine
• PubChem CID: 160757980
• Molecular Formula: C211H130N8O7
• Molecular Weight: 2889.41 g/mol
• Exact Mass: 2887.01
• IUPAC Name: N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine
• SMILES: c1ccc(-c2ccc(N(c3ccc(-c4ccc5c6cccc7c6n(c5c4)-c4ccccc4O7)cc3)c3cccc4oc5ccccc5c34)cc2)cc1.c1ccc2c(c1)Oc1cccc3c4ccc(-c5ccc(N(c6ccc(-c7ccc8ccccc8c7)cc6)c6cccc7c6oc6ccccc67)cc5)cc4n-2c13.c1ccc2c(c1)Oc1cccc3c4ccc(-c5ccc(N(c6ccc(-c7cccc8ccccc78)cc6)c6ccc7c(c6)oc6ccccc67)cc5)cc4n-2c13.c1ccc2c(c1)Oc1cccc3c4ccc(-c5ccc(N(c6cccc7c6-c6ccccc6C76c7ccccc7-c7ccccc76)c6cccc7ccccc67)cc5)cc4n-2c13
• InChI: InChI=1S/C59H36N2O.2C52H32N2O2.C48H30N2O2/c1-2-16-41-38(14-1)15-11-26-51(41)60(53-27-13-24-50-57(53)46-19-5-8-23-49(46)59(50)47-21-6-3-17-42(47)43-18-4-7-22-48(43)59)40-33-30-37(31-34-40)39-32-35-44-45-20-12-29-56-58(45)61(54(44)36-39)52-25-9-10-28-55(52)62-56;1-2-11-40-34(9-1)10-7-13-41(40)35-21-26-38(27-22-35)53(39-28-30-44-43-12-3-5-16-48(43)55-51(44)32-39)37-24-19-33(20-25-37)36-23-29-42-45-14-8-18-50-52(45)54(47(42)31-36)46-15-4-6-17-49(46)56-50;1-2-10-36-31-37(20-19-33(36)9-1)34-21-26-39(27-22-34)53(46-15-7-13-44-42-11-3-5-16-48(42)56-52(44)46)40-28-23-35(24-29-40)38-25-30-41-43-12-8-18-50-51(43)54(47(41)32-38)45-14-4-6-17-49(45)55-50;1-2-10-31(11-3-1)32-20-25-35(26-21-32)49(41-15-9-18-45-47(41)39-12-4-6-16-43(39)51-45)36-27-22-33(23-28-36)34-24-29-37-38-13-8-19-46-48(38)50(42(37)30-34)40-14-5-7-17-44(40)52-46/h1-36H;2*1-32H;1-30H
• InChIKey: RXRJBYMAGWPLRJ-UHFFFAOYSA-N
• XLogP: 58.61
• TPSA: 109.02 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 19
• Heavy Atoms: 226
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2889.41
LogP ≤ 5	58.61
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine?

The IUPAC name of N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine (CID 160757980) is N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine.

What is the SMILES notation for N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine?

The canonical SMILES for N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccc5c6cccc7c6n(c5c4)-c4ccccc4O7)cc3)c3cccc4oc5ccccc5c34)cc2)cc1.c1ccc2c(c1)Oc1cccc3c4ccc(-c5ccc(N(c6ccc(-c7ccc8ccccc8c7)cc6)c6cccc7c6oc6ccccc67)cc5)cc4n-2c13.c1ccc2c(c1)Oc1cccc3c4ccc(-c5ccc(N(c6ccc(-c7cccc8ccccc78)cc6)c6ccc7c(c6)oc6ccccc67)cc5)cc4n-2c13.c1ccc2c(c1)Oc1cccc3c4ccc(-c5ccc(N(c6cccc7c6-c6ccccc6C76c7ccccc7-c7ccccc76)c6cccc7ccccc67)cc5)cc4n-2c13.

What is the InChIKey of N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine?

The InChIKey is RXRJBYMAGWPLRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C59H36N2O.2C52H32N2O2.C48H30N2O2/c1-2-16-41-38(14-1)15-11-26-51(41)60(53-27-13-24-50-57(53)46-19-5-8-23-49(46)59(50)47-21-6-3-17-42(47)43-18-4-7-22-48(43)59)40-33-30-37(31-34-40)39-32-35-44-45-20-12-29-56-58(45)61(54(44)36-39)52-25-9-10-28-55(52)62-56;1-2-11-40-34(9-1)10-7-13-41(40)35-21-26-38(27-22-35)53(39-28-30-44-43-12-3-5-16-48(43)55-51(44)32-39)37-24-19-33(20-25-37)36-23-29-42-45-14-8-18-50-52(45)54(47(42)31-36)46-15-4-6-17-49(46)56-50;1-2-10-36-31-37(20-19-33(36)9-1)34-21-26-39(27-22-34)53(46-15-7-13-44-42-11-3-5-16-48(42)56-52(44)46)40-28-23-35(24-29-40)38-25-30-41-43-12-8-18-50-51(43)54(47(41)32-38)45-14-4-6-17-49(45)55-50;1-2-10-31(11-3-1)32-20-25-35(26-21-32)49(41-15-9-18-45-47(41)39-12-4-6-16-43(39)51-45)36-27-22-33(23-28-36)34-24-29-37-38-13-8-19-46-48(38)50(42(37)30-34)40-14-5-7-17-44(40)52-46/h1-36H;2*1-32H;1-30H.

What are the key properties of N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine?

N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine has a molecular weight of 2889.41 g/mol, XLogP of 58.61, 19 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for N-naphthalen-1-yl-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(4-naphthalen-1-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-3-amine;N-(4-naphthalen-2-ylphenyl)-N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]dibenzofuran-4-amine;N-[4-(13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2(7),3,5,8(20),9,11,14,16,18-nonaen-4-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-1-amine is sourced from PubChem (CID 160757980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).