N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine

C180H130N4O4SSi4 — CID 165095565

About N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine

N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine (PubChem CID 165095565) has the molecular formula C180H130N4O4SSi4 and a molecular weight of 2557.45 g/mol. Its IUPAC name is N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine.

Molecular Properties

• Compound Name: N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine
• PubChem CID: 165095565
• Molecular Formula: C180H130N4O4SSi4
• Molecular Weight: 2557.45 g/mol
• Exact Mass: 2554.89
• IUPAC Name: N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine
• SMILES: C[Si]1(C)c2cc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4oc5ccccc5c34)ccc2-c2ccc3oc4ccccc4c3c21.C[Si]1(C)c2cc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccccc3-c3ccccc3)ccc2-c2ccc3oc4ccccc4c3c21.C[Si]1(C)c2cc(N(c3ccccc3)c3ccc(-c4ccc5ccccc5c4)cc3)ccc2-c2ccc3sc4ccccc4c3c21.C[Si]1(C)c2cc(N(c3ccccc3)c3ccc(-c4cccc5ccccc45)cc3)ccc2-c2ccc3oc4ccccc4c3c21
• InChI: InChI=1S/C48H33NO2Si.C48H35NOSi.C42H31NOSi.C42H31NSSi/c1-52(2)45-29-35(24-25-36(45)37-26-27-44-47(48(37)52)39-13-6-8-16-42(39)51-44)49(40-14-9-17-43-46(40)38-12-5-7-15-41(38)50-43)34-22-20-31(21-23-34)33-19-18-30-10-3-4-11-32(30)28-33;1-51(2)46-31-38(26-27-40(46)41-28-29-45-47(48(41)51)42-17-9-11-19-44(42)50-45)49(43-18-10-8-16-39(43)34-13-4-3-5-14-34)37-24-22-33(23-25-37)36-21-20-32-12-6-7-15-35(32)30-36;1-45(2)40-27-32(23-24-35(40)36-25-26-39-41(42(36)45)37-16-8-9-18-38(37)44-39)43(30-13-4-3-5-14-30)31-21-19-29(20-22-31)34-17-10-12-28-11-6-7-15-33(28)34;1-45(2)40-27-34(22-23-35(40)36-24-25-39-41(42(36)45)37-14-8-9-15-38(37)44-39)43(32-12-4-3-5-13-32)33-20-18-29(19-21-33)31-17-16-28-10-6-7-11-30(28)26-31/h3-29H,1-2H3;3-31H,1-2H3;2*3-27H,1-2H3
• InChIKey: XLFZAYAJZUSGSF-UHFFFAOYSA-N
• XLogP: 46.75
• TPSA: 65.52 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 17
• Heavy Atoms: 193
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2557.45
LogP ≤ 5	46.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

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-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine?

The IUPAC name of N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine (CID 165095565) is N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine.

What is the SMILES notation for N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine?

The canonical SMILES for N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine is C[Si]1(C)c2cc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3cccc4oc5ccccc5c34)ccc2-c2ccc3oc4ccccc4c3c21.C[Si]1(C)c2cc(N(c3ccc(-c4ccc5ccccc5c4)cc3)c3ccccc3-c3ccccc3)ccc2-c2ccc3oc4ccccc4c3c21.C[Si]1(C)c2cc(N(c3ccccc3)c3ccc(-c4ccc5ccccc5c4)cc3)ccc2-c2ccc3sc4ccccc4c3c21.C[Si]1(C)c2cc(N(c3ccccc3)c3ccc(-c4cccc5ccccc45)cc3)ccc2-c2ccc3oc4ccccc4c3c21.

What is the InChIKey of N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine?

The InChIKey is XLFZAYAJZUSGSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H33NO2Si.C48H35NOSi.C42H31NOSi.C42H31NSSi/c1-52(2)45-29-35(24-25-36(45)37-26-27-44-47(48(37)52)39-13-6-8-16-42(39)51-44)49(40-14-9-17-43-46(40)38-12-5-7-15-41(38)50-43)34-22-20-31(21-23-34)33-19-18-30-10-3-4-11-32(30)28-33;1-51(2)46-31-38(26-27-40(46)41-28-29-45-47(48(41)51)42-17-9-11-19-44(42)50-45)49(43-18-10-8-16-39(43)34-13-4-3-5-14-34)37-24-22-33(23-25-37)36-21-20-32-12-6-7-15-35(32)30-36;1-45(2)40-27-32(23-24-35(40)36-25-26-39-41(42(36)45)37-16-8-9-18-38(37)44-39)43(30-13-4-3-5-14-30)31-21-19-29(20-22-31)34-17-10-12-28-11-6-7-15-33(28)34;1-45(2)40-27-34(22-23-35(40)36-24-25-39-41(42(36)45)37-14-8-9-15-38(37)44-39)43(32-12-4-3-5-13-32)33-20-18-29(19-21-33)31-17-16-28-10-6-7-11-30(28)26-31/h3-29H,1-2H3;3-31H,1-2H3;2*3-27H,1-2H3.

What are the key properties of N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine?

N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine has a molecular weight of 2557.45 g/mol, XLogP of 46.75, 17 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for N-dibenzofuran-1-yl-20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-phenyl-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-(2-phenylphenyl)-9-oxa-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine;20,20-dimethyl-N-(4-naphthalen-2-ylphenyl)-N-phenyl-9-thia-20-silapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-17-amine is sourced from PubChem (CID 165095565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).