N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine

C144H86N6O5 — CID 158050719

About N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine

N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine (PubChem CID 158050719) has the molecular formula C144H86N6O5 and a molecular weight of 1980.31 g/mol. Its IUPAC name is N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine.

Molecular Properties

• Compound Name: N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine
• PubChem CID: 158050719
• Molecular Formula: C144H86N6O5
• Molecular Weight: 1980.31 g/mol
• Exact Mass: 1978.67
• IUPAC Name: N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine
• SMILES: c1ccc(-c2ccc(N(c3ccc(-c4cc5c6ccccc6n6c7ccccc7c(c4)c56)cc3)c3cccc4c3oc3ccccc34)cc2)cc1.c1ccc2c(c1)oc1cc(N(c3ccc(-c4cc5c6ccccc6n6c7ccccc7c(c4)c56)cc3)c3ccc4c(c3)oc3ccccc34)ccc12.c1ccc2c(c1)oc1cc(N(c3ccc(-c4cc5c6ccccc6n6c7ccccc7c(c4)c56)cc3)c3ccc4oc5ccccc5c4c3)ccc12
• InChI: InChI=1S/2C48H28N2O2.C48H30N2O/c1-5-13-42-34(9-1)40-25-30(26-41-35-10-2-6-14-43(35)50(42)48(40)41)29-17-19-31(20-18-29)49(32-22-24-46-39(27-32)37-12-4-8-16-45(37)51-46)33-21-23-38-36-11-3-7-15-44(36)52-47(38)28-33;1-5-13-42-34(9-1)40-25-30(26-41-35-10-2-6-14-43(35)50(42)48(40)41)29-17-19-31(20-18-29)49(32-21-23-38-36-11-3-7-15-44(36)51-46(38)27-32)33-22-24-39-37-12-4-8-16-45(37)52-47(39)28-33;1-2-11-31(12-3-1)32-21-25-35(26-22-32)49(45-19-10-16-40-39-15-6-9-20-46(39)51-48(40)45)36-27-23-33(24-28-36)34-29-41-37-13-4-7-17-43(37)50-44-18-8-5-14-38(44)42(30-34)47(41)50/h2*1-28H;1-30H
• InChIKey: FJLGKODLOPSMHF-UHFFFAOYSA-N
• XLogP: 41.08
• TPSA: 88.65 Ų
• H-Bond Acceptors: 11
• Rotatable Bonds: 13
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1980.31
LogP ≤ 5	41.08
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	11

Frequently Asked Questions

What is the IUPAC name of N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine?

The IUPAC name of N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine (CID 158050719) is N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine.

What is the SMILES notation for N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine?

The canonical SMILES for N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine is c1ccc(-c2ccc(N(c3ccc(-c4cc5c6ccccc6n6c7ccccc7c(c4)c56)cc3)c3cccc4c3oc3ccccc34)cc2)cc1.c1ccc2c(c1)oc1cc(N(c3ccc(-c4cc5c6ccccc6n6c7ccccc7c(c4)c56)cc3)c3ccc4c(c3)oc3ccccc34)ccc12.c1ccc2c(c1)oc1cc(N(c3ccc(-c4cc5c6ccccc6n6c7ccccc7c(c4)c56)cc3)c3ccc4oc5ccccc5c4c3)ccc12.

What is the InChIKey of N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine?

The InChIKey is FJLGKODLOPSMHF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C48H28N2O2.C48H30N2O/c1-5-13-42-34(9-1)40-25-30(26-41-35-10-2-6-14-43(35)50(42)48(40)41)29-17-19-31(20-18-29)49(32-22-24-46-39(27-32)37-12-4-8-16-45(37)51-46)33-21-23-38-36-11-3-7-15-44(36)52-47(38)28-33;1-5-13-42-34(9-1)40-25-30(26-41-35-10-2-6-14-43(35)50(42)48(40)41)29-17-19-31(20-18-29)49(32-21-23-38-36-11-3-7-15-44(36)51-46(38)27-32)33-22-24-39-37-12-4-8-16-45(37)52-47(39)28-33;1-2-11-31(12-3-1)32-21-25-35(26-22-32)49(45-19-10-16-40-39-15-6-9-20-46(39)51-48(40)45)36-27-23-33(24-28-36)34-29-41-37-13-4-7-17-43(37)50-44-18-8-5-14-38(44)42(30-34)47(41)50/h2*1-28H;1-30H.

What are the key properties of N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine?

N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine has a molecular weight of 1980.31 g/mol, XLogP of 41.08, 13 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-2-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-dibenzofuran-3-yldibenzofuran-3-amine;N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine is sourced from PubChem (CID 158050719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).