3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine

C251H243N7O2 — CID 159293011

IUPAC3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine
SMILESc1cc(C23CC4CC(C2)CC(c2ccc(N5C6CC7CC(C6)CC5C7)cc2)(C4)C3)ccc1N1C2CC3CC(C2)CC1C3.c1cc(C23CC4CC(CC(C4)C2)C3)ccc1N(c1ccc(C23CC4CC(CC(C4)C2)C3)cc1)c1ccc(C23CC4CC(CC(C4)C2)C3)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4cccc(C56CC7CC(CC(C7)C5)C6)c4)cc3)cc2)c2cccc(C34CC5CC(CC(C5)C3)C4)c2)cc1.c1ccc2c(c1)oc1c(-c3ccc(N(c4ccc(-c5ccc(C67CC8CC(CC(C8)C6)C7)cc5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cccc12
InChIInChI=1S/C58H45NO2.C56H56N2.C49H35N.C48H57N.C40H50N2/c1-3-13-54-50(7-1)52-11-5-9-48(56(52)60-54)42-19-27-46(28-20-42)59(47-29-21-43(22-30-47)49-10-6-12-53-51-8-2-4-14-55(51)61-57(49)53)45-25-17-41(18-26-45)40-15-23-44(24-16-40)58-34-37-31-38(35-58)33-39(32-37)36-58;1-3-11-49(12-4-1)57(53-15-7-9-47(31-53)55-33-39-25-40(34-55)27-41(26-39)35-55)51-21-17-45(18-22-51)46-19-23-52(24-20-46)58(50-13-5-2-6-14-50)54-16-8-10-48(32-54)56-36-42-28-43(37-56)30-44(29-42)38-56;1-5-15-36(16-6-1)38-25-29-42(30-26-38)50(43-31-27-39(28-32-43)37-17-7-2-8-18-37)44-33-34-46-45-23-13-14-24-47(45)49(48(46)35-44,40-19-9-3-10-20-40)41-21-11-4-12-22-41;1-7-43(8-2-40(1)46-22-31-13-32(23-46)15-33(14-31)24-46)49(44-9-3-41(4-10-44)47-25-34-16-35(26-47)18-36(17-34)27-47)45-11-5-42(6-12-45)48-28-37-19-38(29-48)21-39(20-37)30-48;1-5-33(41-35-12-25-9-26(14-35)15-36(41)13-25)6-2-31(1)39-20-29-11-30(21-39)23-40(22-29,24-39)32-3-7-34(8-4-32)42-37-16-27-10-28(18-37)19-38(42)17-27/h1-30,37-39H,31-36H2;1-24,31-32,39-44H,25-30,33-38H2;1-35H;1-12,31-39H,13-30H2;1-8,25-30,35-38H,9-24H2
InChIKeyLAJATUXGGIZYQB-UHFFFAOYSA-N
MW3389.75 g/mol
LogP66.08
Rot. Bonds33

About 3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine

3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine (PubChem CID 159293011) has the molecular formula C251H243N7O2 and a molecular weight of 3389.75 g/mol. Its IUPAC name is 3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

Compound Name3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine
PubChem CID159293011
Molecular FormulaC251H243N7O2
Molecular Weight3389.75 g/mol
Exact Mass3386.91
IUPAC Name3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine
SMILESc1cc(C23CC4CC(C2)CC(c2ccc(N5C6CC7CC(C6)CC5C7)cc2)(C4)C3)ccc1N1C2CC3CC(C2)CC1C3.c1cc(C23CC4CC(CC(C4)C2)C3)ccc1N(c1ccc(C23CC4CC(CC(C4)C2)C3)cc1)c1ccc(C23CC4CC(CC(C4)C2)C3)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4cccc(C56CC7CC(CC(C7)C5)C6)c4)cc3)cc2)c2cccc(C34CC5CC(CC(C5)C3)C4)c2)cc1.c1ccc2c(c1)oc1c(-c3ccc(N(c4ccc(-c5ccc(C67CC8CC(CC(C8)C6)C7)cc5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cccc12
InChIInChI=1S/C58H45NO2.C56H56N2.C49H35N.C48H57N.C40H50N2/c1-3-13-54-50(7-1)52-11-5-9-48(56(52)60-54)42-19-27-46(28-20-42)59(47-29-21-43(22-30-47)49-10-6-12-53-51-8-2-4-14-55(51)61-57(49)53)45-25-17-41(18-26-45)40-15-23-44(24-16-40)58-34-37-31-38(35-58)33-39(32-37)36-58;1-3-11-49(12-4-1)57(53-15-7-9-47(31-53)55-33-39-25-40(34-55)27-41(26-39)35-55)51-21-17-45(18-22-51)46-19-23-52(24-20-46)58(50-13-5-2-6-14-50)54-16-8-10-48(32-54)56-36-42-28-43(37-56)30-44(29-42)38-56;1-5-15-36(16-6-1)38-25-29-42(30-26-38)50(43-31-27-39(28-32-43)37-17-7-2-8-18-37)44-33-34-46-45-23-13-14-24-47(45)49(48(46)35-44,40-19-9-3-10-20-40)41-21-11-4-12-22-41;1-7-43(8-2-40(1)46-22-31-13-32(23-46)15-33(14-31)24-46)49(44-9-3-41(4-10-44)47-25-34-16-35(26-47)18-36(17-34)27-47)45-11-5-42(6-12-45)48-28-37-19-38(29-48)21-39(20-37)30-48;1-5-33(41-35-12-25-9-26(14-35)15-36(41)13-25)6-2-31(1)39-20-29-11-30(21-39)23-40(22-29,24-39)32-3-7-34(8-4-32)42-37-16-27-10-28(18-37)19-38(42)17-27/h1-30,37-39H,31-36H2;1-24,31-32,39-44H,25-30,33-38H2;1-35H;1-12,31-39H,13-30H2;1-8,25-30,35-38H,9-24H2
InChIKeyLAJATUXGGIZYQB-UHFFFAOYSA-N
XLogP66.08
TPSA48.96 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds33
Heavy Atoms260
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003389.75
LogP ≤ 566.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine with MolForge

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Related Compounds

N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-N,4-diphenylaniline
CID 164769137
N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 164768992
N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-(2-phenylphenyl)fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 158287693
N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[3-(2-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[3-(3-phenylphenyl)phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 161367411
N-[4-[3,5-di(dibenzofuran-4-yl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 121383311
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 121381438
N-[4-[4-(1-adamantyl)phenyl]phenyl]-3-dibenzofuran-4-yl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 169028672
N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 118298039
9,9-diphenyl-N-(2,3,5,6-tetradeuterio-4-dibenzofuran-4-ylphenyl)-N-[2,3,5,6-tetradeuterio-4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 171452548
4-(4-carbazol-9-ylphenyl)-N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-N-phenylaniline
CID 164769104
N-(4-dibenzofuran-4-ylphenyl)-N,2-diphenyl-9,9'-spirobi[fluorene]-2'-amine
CID 118298489
N-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 164769090

Frequently Asked Questions

What is the IUPAC name of 3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The IUPAC name of 3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine (CID 159293011) is 3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine.
What is the SMILES notation for 3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The canonical SMILES for 3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine is c1cc(C23CC4CC(C2)CC(c2ccc(N5C6CC7CC(C6)CC5C7)cc2)(C4)C3)ccc1N1C2CC3CC(C2)CC1C3.c1cc(C23CC4CC(CC(C4)C2)C3)ccc1N(c1ccc(C23CC4CC(CC(C4)C2)C3)cc1)c1ccc(C23CC4CC(CC(C4)C2)C3)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4cccc(C56CC7CC(CC(C7)C5)C6)c4)cc3)cc2)c2cccc(C34CC5CC(CC(C5)C3)C4)c2)cc1.c1ccc2c(c1)oc1c(-c3ccc(N(c4ccc(-c5ccc(C67CC8CC(CC(C8)C6)C7)cc5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cccc12.
What is the InChIKey of 3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine?
The InChIKey is LAJATUXGGIZYQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H45NO2.C56H56N2.C49H35N.C48H57N.C40H50N2/c1-3-13-54-50(7-1)52-11-5-9-48(56(52)60-54)42-19-27-46(28-20-42)59(47-29-21-43(22-30-47)49-10-6-12-53-51-8-2-4-14-55(51)61-57(49)53)45-25-17-41(18-26-45)40-15-23-44(24-16-40)58-34-37-31-38(35-58)33-39(32-37)36-58;1-3-11-49(12-4-1)57(53-15-7-9-47(31-53)55-33-39-25-40(34-55)27-41(26-39)35-55)51-21-17-45(18-22-51)46-19-23-52(24-20-46)58(50-13-5-2-6-14-50)54-16-8-10-48(32-54)56-36-42-28-43(37-56)30-44(29-42)38-56;1-5-15-36(16-6-1)38-25-29-42(30-26-38)50(43-31-27-39(28-32-43)37-17-7-2-8-18-37)44-33-34-46-45-23-13-14-24-47(45)49(48(46)35-44,40-19-9-3-10-20-40)41-21-11-4-12-22-41;1-7-43(8-2-40(1)46-22-31-13-32(23-46)15-33(14-31)24-46)49(44-9-3-41(4-10-44)47-25-34-16-35(26-47)18-36(17-34)27-47)45-11-5-42(6-12-45)48-28-37-19-38(29-48)21-39(20-37)30-48;1-5-33(41-35-12-25-9-26(14-35)15-36(41)13-25)6-2-31(1)39-20-29-11-30(21-39)23-40(22-29,24-39)32-3-7-34(8-4-32)42-37-16-27-10-28(18-37)19-38(42)17-27/h1-30,37-39H,31-36H2;1-24,31-32,39-44H,25-30,33-38H2;1-35H;1-12,31-39H,13-30H2;1-8,25-30,35-38H,9-24H2.
What are the key properties of 3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine?
3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine has a molecular weight of 3389.75 g/mol, XLogP of 66.08, 33 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-adamantyl)-N-[4-[4-(N-[3-(1-adamantyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;4-(1-adamantyl)-N,N-bis[4-(1-adamantyl)phenyl]aniline;4-[4-(1-adamantyl)phenyl]-N,N-bis(4-dibenzofuran-4-ylphenyl)aniline;2-[4-[3-[4-(2-azatricyclo[3.3.1.13,7]decan-2-yl)phenyl]-1-adamantyl]phenyl]-2-azatricyclo[3.3.1.13,7]decane;9,9-diphenyl-N,N-bis(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 159293011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).