N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline

C180H135N3S — CID 159815958

IUPACN,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4cccc(-c5cccc(-c6ccc7c(c6)sc6ccccc67)c5)c4)c4ccccc4-c4ccccc4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5-c5ccccc5)c4)c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cccc(N(c5cccc(-c6cccc(-c7ccc8c(c7)C(C)(C)c7ccccc7-8)c6)c5)c5ccccc5-c5ccccc5)c4)c3)cc21
InChIInChI=1S/C66H51N.C57H41NS.C57H43N/c1-65(2)60-31-11-8-29-56(60)58-36-34-51(42-62(58)65)47-22-14-20-45(38-47)49-24-16-26-53(40-49)67(64-33-13-10-28-55(64)44-18-6-5-7-19-44)54-27-17-25-50(41-54)46-21-15-23-48(39-46)52-35-37-59-57-30-9-12-32-61(57)66(3,4)63(59)43-52;1-57(2)52-23-9-6-21-48(52)49-32-28-43(36-53(49)57)38-26-30-45(31-27-38)58(54-24-10-7-20-47(54)39-14-4-3-5-15-39)46-19-13-18-42(35-46)40-16-12-17-41(34-40)44-29-33-51-50-22-8-11-25-55(50)59-56(51)37-44;1-57(2)54-27-13-12-26-51(54)52-34-30-48(39-55(52)57)45-23-14-22-44(36-45)46-24-15-25-50(37-46)58(49-32-28-42(29-33-49)40-16-6-3-7-17-40)56-35-31-47(41-18-8-4-9-19-41)38-53(56)43-20-10-5-11-21-43/h5-43H,1-4H3;3-37H,1-2H3;3-39H,1-2H3
InChIKeyNLPVIFFVGJVOBA-UHFFFAOYSA-N
MW2372.15 g/mol
LogP50.40
Rot. Bonds23

About N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline

N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline (PubChem CID 159815958) has the molecular formula C180H135N3S and a molecular weight of 2372.15 g/mol. Its IUPAC name is N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline.

Molecular Properties

Compound NameN,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline
PubChem CID159815958
Molecular FormulaC180H135N3S
Molecular Weight2372.15 g/mol
Exact Mass2370.04
IUPAC NameN,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4cccc(-c5cccc(-c6ccc7c(c6)sc6ccccc67)c5)c4)c4ccccc4-c4ccccc4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5-c5ccccc5)c4)c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cccc(N(c5cccc(-c6cccc(-c7ccc8c(c7)C(C)(C)c7ccccc7-8)c6)c5)c5ccccc5-c5ccccc5)c4)c3)cc21
InChIInChI=1S/C66H51N.C57H41NS.C57H43N/c1-65(2)60-31-11-8-29-56(60)58-36-34-51(42-62(58)65)47-22-14-20-45(38-47)49-24-16-26-53(40-49)67(64-33-13-10-28-55(64)44-18-6-5-7-19-44)54-27-17-25-50(41-54)46-21-15-23-48(39-46)52-35-37-59-57-30-9-12-32-61(57)66(3,4)63(59)43-52;1-57(2)52-23-9-6-21-48(52)49-32-28-43(36-53(49)57)38-26-30-45(31-27-38)58(54-24-10-7-20-47(54)39-14-4-3-5-15-39)46-19-13-18-42(35-46)40-16-12-17-41(34-40)44-29-33-51-50-22-8-11-25-55(50)59-56(51)37-44;1-57(2)54-27-13-12-26-51(54)52-34-30-48(39-55(52)57)45-23-14-22-44(36-45)46-24-15-25-50(37-46)58(49-32-28-42(29-33-49)40-16-6-3-7-17-40)56-35-31-47(41-18-8-4-9-19-41)38-53(56)43-20-10-5-11-21-43/h5-43H,1-4H3;3-37H,1-2H3;3-39H,1-2H3
InChIKeyNLPVIFFVGJVOBA-UHFFFAOYSA-N
XLogP50.40
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds23
Heavy Atoms184
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002372.15
LogP ≤ 550.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline with MolForge

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Related Compounds

2-dibenzothiophen-3-yl-N-[3-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-N-(3-phenylphenyl)aniline
CID 168839739
N-[4-[7-(9,9-dimethylfluoren-2-yl)dibenzothiophen-3-yl]phenyl]-9,9-dimethyl-N-(2-phenylphenyl)fluoren-2-amine
CID 164724672
N-(3-dibenzothiophen-2-ylphenyl)-9,9-dimethyl-N-(2-phenylphenyl)-7-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121321713
N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-3-phenylaniline
CID 168839480
2-dibenzothiophen-3-yl-N-[3-(9,9-dimethyl-5,7-diphenylfluoren-3-yl)phenyl]-N-(3-phenylphenyl)aniline
CID 168839721
N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-3-naphthalen-2-ylaniline
CID 167323779
N-(4-dibenzothiophen-3-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-3-(3,4-diphenylphenyl)triphenylen-2-amine
CID 177294573
N-(9,9-dimethylfluoren-2-yl)-N-[2-(2,6-dimethylphenyl)-4-(4-phenylphenyl)phenyl]dibenzothiophen-3-amine
CID 155220978
N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-9,9-dimethylfluoren-2-amine
CID 168839548
N-[2-(9,9-dimethyl-5-phenylfluoren-3-yl)phenyl]-N-(4-phenylphenyl)dibenzothiophen-3-amine
CID 169039618
N-(2-tert-butyl-4-phenylphenyl)-N-(4-dibenzothiophen-3-ylphenyl)-9,9-dimethylfluoren-2-amine
CID 176781079
N-(2-dibenzothiophen-1-ylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 176583255

Frequently Asked Questions

What is the IUPAC name of N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline?
The IUPAC name of N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline (CID 159815958) is N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline.
What is the SMILES notation for N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline?
The canonical SMILES for N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline is CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4cccc(-c5cccc(-c6ccc7c(c6)sc6ccccc67)c5)c4)c4ccccc4-c4ccccc4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cccc(N(c5ccc(-c6ccccc6)cc5)c5ccc(-c6ccccc6)cc5-c5ccccc5)c4)c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cccc(N(c5cccc(-c6cccc(-c7ccc8c(c7)C(C)(C)c7ccccc7-8)c6)c5)c5ccccc5-c5ccccc5)c4)c3)cc21.
What is the InChIKey of N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline?
The InChIKey is NLPVIFFVGJVOBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H51N.C57H41NS.C57H43N/c1-65(2)60-31-11-8-29-56(60)58-36-34-51(42-62(58)65)47-22-14-20-45(38-47)49-24-16-26-53(40-49)67(64-33-13-10-28-55(64)44-18-6-5-7-19-44)54-27-17-25-50(41-54)46-21-15-23-48(39-46)52-35-37-59-57-30-9-12-32-61(57)66(3,4)63(59)43-52;1-57(2)52-23-9-6-21-48(52)49-32-28-43(36-53(49)57)38-26-30-45(31-27-38)58(54-24-10-7-20-47(54)39-14-4-3-5-15-39)46-19-13-18-42(35-46)40-16-12-17-41(34-40)44-29-33-51-50-22-8-11-25-55(50)59-56(51)37-44;1-57(2)54-27-13-12-26-51(54)52-34-30-48(39-55(52)57)45-23-14-22-44(36-45)46-24-15-25-50(37-46)58(49-32-28-42(29-33-49)40-16-6-3-7-17-40)56-35-31-47(41-18-8-4-9-19-41)38-53(56)43-20-10-5-11-21-43/h5-43H,1-4H3;3-37H,1-2H3;3-39H,1-2H3.
What are the key properties of N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline?
N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline has a molecular weight of 2372.15 g/mol, XLogP of 50.40, 23 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2-phenylaniline;N-[3-(3-dibenzothiophen-3-ylphenyl)phenyl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-2,4-diphenyl-N-(4-phenylphenyl)aniline is sourced from PubChem (CID 159815958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).