N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine

C149H98N6O3 — CID 160667855

About N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine

N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine (PubChem CID 160667855) has the molecular formula C149H98N6O3 and a molecular weight of 2020.46 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine.

Molecular Properties

• Compound Name: N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine
• PubChem CID: 160667855
• Molecular Formula: C149H98N6O3
• Molecular Weight: 2020.46 g/mol
• Exact Mass: 2018.77
• IUPAC Name: N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine
• SMILES: c1ccc(-c2ccc(N(c3ccc(-c4cccnc4)cc3)c3ccc4c5c(cccc35)-c3ccccc3O4)cc2)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccc6c7c(cccc57)-c5ccccc5O6)cc4)c4cccnc4)cc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5cccnc5)cc4)c4ccc(-c5ccc6c7c(cccc57)-c5ccccc5O6)cc4)cc32)cc1
• InChI: InChI=1S/C58H38N2O.C52H34N2O.C39H26N2O/c1-3-14-42(15-4-1)58(43-16-5-2-6-17-43)53-22-9-7-18-48(53)49-33-32-46(37-54(49)58)60(44-28-24-39(25-29-44)41-13-12-36-59-38-41)45-30-26-40(27-31-45)47-34-35-56-57-51(47)20-11-21-52(57)50-19-8-10-23-55(50)61-56;1-3-13-36(14-4-1)52(37-15-5-2-6-16-37)47-22-9-7-18-42(47)43-29-28-39(33-48(43)52)54(40-17-12-32-53-34-40)38-26-24-35(25-27-38)41-30-31-50-51-45(41)20-11-21-46(51)44-19-8-10-23-49(44)55-50;1-2-8-27(9-3-1)28-15-19-31(20-16-28)41(32-21-17-29(18-22-32)30-10-7-25-40-26-30)36-23-24-38-39-34(12-6-13-35(36)39)33-11-4-5-14-37(33)42-38/h1-38H;1-34H;1-26H
• InChIKey: RMNTVGRQQQUQHY-UHFFFAOYSA-N
• XLogP: 39.49
• TPSA: 76.08 Ų
• H-Bond Acceptors: 9
• Rotatable Bonds: 18
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2020.46
LogP ≤ 5	39.49
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine?

The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine (CID 160667855) is N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine.

What is the SMILES notation for N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine?

The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine is c1ccc(-c2ccc(N(c3ccc(-c4cccnc4)cc3)c3ccc4c5c(cccc35)-c3ccccc3O4)cc2)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccc6c7c(cccc57)-c5ccccc5O6)cc4)c4cccnc4)cc32)cc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5cccnc5)cc4)c4ccc(-c5ccc6c7c(cccc57)-c5ccccc5O6)cc4)cc32)cc1.

What is the InChIKey of N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine?

The InChIKey is RMNTVGRQQQUQHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H38N2O.C52H34N2O.C39H26N2O/c1-3-14-42(15-4-1)58(43-16-5-2-6-17-43)53-22-9-7-18-48(53)49-33-32-46(37-54(49)58)60(44-28-24-39(25-29-44)41-13-12-36-59-38-41)45-30-26-40(27-31-45)47-34-35-56-57-51(47)20-11-21-52(57)50-19-8-10-23-55(50)61-56;1-3-13-36(14-4-1)52(37-15-5-2-6-16-37)47-22-9-7-18-42(47)43-29-28-39(33-48(43)52)54(40-17-12-32-53-34-40)38-26-24-35(25-27-38)41-30-31-50-51-45(41)20-11-21-46(51)44-19-8-10-23-49(44)55-50;1-2-8-27(9-3-1)28-15-19-31(20-16-28)41(32-21-17-29(18-22-32)30-10-7-25-40-26-30)36-23-24-38-39-34(12-6-13-35(36)39)33-11-4-5-14-37(33)42-38/h1-38H;1-34H;1-26H.

What are the key properties of N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine?

N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine has a molecular weight of 2020.46 g/mol, XLogP of 39.49, 18 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for N-(9,9-diphenylfluoren-2-yl)-N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]pyridin-3-amine;N-[4-(8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-yl)phenyl]-9,9-diphenyl-N-(4-pyridin-3-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(4-pyridin-3-ylphenyl)-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-12-amine is sourced from PubChem (CID 160667855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).