N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine

C154H97N3O6 — CID 164995914

About N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine

N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine (PubChem CID 164995914) has the molecular formula C154H97N3O6 and a molecular weight of 2085.48 g/mol. Its IUPAC name is N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine.

Molecular Properties

• Compound Name: N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine
• PubChem CID: 164995914
• Molecular Formula: C154H97N3O6
• Molecular Weight: 2085.48 g/mol
• Exact Mass: 2083.74
• IUPAC Name: N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine
• SMILES: c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)c4c5ccccc5cc5c4oc4c5ccc5oc6ccccc6c54)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3cc4ccccc4c4c3oc3c4ccc4oc5ccccc5c43)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4c3oc3c4c4ccccc4c4oc5ccccc5c43)cc2)cc1
• InChI: InChI=1S/C58H37NO2.C50H31NO2.C46H29NO2/c1-3-11-38(12-4-1)40-19-23-42(24-20-40)44-27-31-47(32-28-44)59(48-33-29-45(30-34-48)43-25-21-41(22-26-43)39-13-5-2-6-14-39)56-49-16-8-7-15-46(49)37-52-50-35-36-54-55(57(50)61-58(52)56)51-17-9-10-18-53(51)60-54;1-2-11-32(12-3-1)33-21-25-37(26-22-33)51(38-27-23-35(24-28-38)40-19-10-15-34-13-4-6-16-39(34)40)44-31-36-14-5-7-17-41(36)47-43-29-30-46-48(49(43)53-50(44)47)42-18-8-9-20-45(42)52-46;1-3-12-30(13-4-1)32-22-26-34(27-23-32)47(35-28-24-33(25-29-35)31-14-5-2-6-15-31)40-20-11-19-39-42-36-16-7-8-17-37(36)45-43(46(42)49-44(39)40)38-18-9-10-21-41(38)48-45/h1-37H;1-31H;1-29H
• InChIKey: HNZSBCVJLAOVFH-UHFFFAOYSA-N
• XLogP: 44.81
• TPSA: 88.56 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 17
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2085.48
LogP ≤ 5	44.81
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine?

The IUPAC name of N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine (CID 164995914) is N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine.

What is the SMILES notation for N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine?

The canonical SMILES for N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)c4c5ccccc5cc5c4oc4c5ccc5oc6ccccc6c54)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4cccc5ccccc45)cc3)c3cc4ccccc4c4c3oc3c4ccc4oc5ccccc5c43)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4c3oc3c4c4ccccc4c4oc5ccccc5c43)cc2)cc1.

What is the InChIKey of N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine?

The InChIKey is HNZSBCVJLAOVFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H37NO2.C50H31NO2.C46H29NO2/c1-3-11-38(12-4-1)40-19-23-42(24-20-40)44-27-31-47(32-28-44)59(48-33-29-45(30-34-48)43-25-21-41(22-26-43)39-13-5-2-6-14-39)56-49-16-8-7-15-46(49)37-52-50-35-36-54-55(57(50)61-58(52)56)51-17-9-10-18-53(51)60-54;1-2-11-32(12-3-1)33-21-25-37(26-22-33)51(38-27-23-35(24-28-38)40-19-10-15-34-13-4-6-16-39(34)40)44-31-36-14-5-7-17-41(36)47-43-29-30-46-48(49(43)53-50(44)47)42-18-8-9-20-45(42)52-46;1-3-12-30(13-4-1)32-22-26-34(27-23-32)47(35-28-24-33(25-29-35)31-14-5-2-6-15-31)40-20-11-19-39-42-36-16-7-8-17-37(36)45-43(46(42)49-44(39)40)38-18-9-10-21-41(38)48-45/h1-37H;1-31H;1-29H.

What are the key properties of N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine?

N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine has a molecular weight of 2085.48 g/mol, XLogP of 44.81, 17 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-bis(4-phenylphenyl)-9,24-dioxahexacyclo[15.7.0.02,10.03,8.011,16.018,23]tetracosa-1(17),2(10),3,5,7,11,13,15,18(23),19,21-undecaen-22-amine;N,N-bis[4-(4-phenylphenyl)phenyl]-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.016,21]tetracosa-1(13),2(10),3,5,7,11,14,16,18,20,22-undecaen-22-amine;N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-9,24-dioxahexacyclo[11.11.0.02,10.03,8.014,23.015,20]tetracosa-1(13),2(10),3,5,7,11,14(23),15,17,19,21-undecaen-22-amine is sourced from PubChem (CID 164995914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).