N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine

C168H111N3O3S2 — CID 163965802

IUPACN-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4oc5ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc5c34)cc21.c1ccc(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4sc5ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc5c4c3)cc2)cc1.c1ccc(-c2cccc(N(c3ccc4c(c3)oc3ccccc34)c3cccc4sc5ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc5c34)c2)cc1
InChIInChI=1S/C58H41NO.2C55H35NOS/c1-57(2)49-23-12-9-20-44(49)47-34-33-43(37-52(47)57)59(42-31-28-39(29-32-42)38-16-5-3-6-17-38)53-26-15-27-55-56(53)48-36-41(30-35-54(48)60-55)58(40-18-7-4-8-19-40)50-24-13-10-21-45(50)46-22-11-14-25-51(46)58;1-3-15-36(16-4-1)37-17-13-20-40(33-37)56(41-30-31-45-44-23-9-12-27-50(44)57-51(45)35-41)49-26-14-28-53-54(49)46-34-39(29-32-52(46)58-53)55(38-18-5-2-6-19-38)47-24-10-7-21-42(47)43-22-8-11-25-48(43)55;1-3-13-36(14-4-1)37-23-26-40(27-24-37)56(41-28-30-52-46(34-41)45-19-9-12-22-51(45)57-52)42-29-32-54-48(35-42)47-33-39(25-31-53(47)58-54)55(38-15-5-2-6-16-38)49-20-10-7-17-43(49)44-18-8-11-21-50(44)55/h3-37H,1-2H3;2*1-35H
InChIKeySLPZTFSTARDFEX-UHFFFAOYSA-N
MW2283.89 g/mol
LogP46.30
Rot. Bonds18

About N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine

N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine (PubChem CID 163965802) has the molecular formula C168H111N3O3S2 and a molecular weight of 2283.89 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine.

Molecular Properties

Compound NameN-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine
PubChem CID163965802
Molecular FormulaC168H111N3O3S2
Molecular Weight2283.89 g/mol
Exact Mass2281.81
IUPAC NameN-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4oc5ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc5c34)cc21.c1ccc(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4sc5ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc5c4c3)cc2)cc1.c1ccc(-c2cccc(N(c3ccc4c(c3)oc3ccccc34)c3cccc4sc5ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc5c34)c2)cc1
InChIInChI=1S/C58H41NO.2C55H35NOS/c1-57(2)49-23-12-9-20-44(49)47-34-33-43(37-52(47)57)59(42-31-28-39(29-32-42)38-16-5-3-6-17-38)53-26-15-27-55-56(53)48-36-41(30-35-54(48)60-55)58(40-18-7-4-8-19-40)50-24-13-10-21-45(50)46-22-11-14-25-51(46)58;1-3-15-36(16-4-1)37-17-13-20-40(33-37)56(41-30-31-45-44-23-9-12-27-50(44)57-51(45)35-41)49-26-14-28-53-54(49)46-34-39(29-32-52(46)58-53)55(38-18-5-2-6-19-38)47-24-10-7-21-42(47)43-22-8-11-25-48(43)55;1-3-13-36(14-4-1)37-23-26-40(27-24-37)56(41-28-30-52-46(34-41)45-19-9-12-22-51(45)57-52)42-29-32-54-48(35-42)47-33-39(25-31-53(47)58-54)55(38-15-5-2-6-16-38)49-20-10-7-17-43(49)44-18-8-11-21-50(44)55/h3-37H,1-2H3;2*1-35H
InChIKeySLPZTFSTARDFEX-UHFFFAOYSA-N
XLogP46.30
TPSA49.14 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds18
Heavy Atoms176
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002283.89
LogP ≤ 546.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine with MolForge

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Related Compounds

N-(9,9-dimethylfluoren-2-yl)-N-[4-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]phenyl]dibenzofuran-3-amine;N,N-diphenyl-2-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]aniline;methane;N-phenyl-3-[3-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]phenyl]-N-(4-phenylphenyl)aniline
CID 163746668
N,N-bis(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)dibenzofuran-3-amine;N-[4-[7-(9-phenylfluoren-9-yl)dibenzofuran-2-yl]phenyl]-N-(3-phenylphenyl)dibenzothiophen-4-amine
CID 163533094
N,N-bis(9,9-dimethylfluoren-2-yl)-7-(9-phenylfluoren-9-yl)dibenzofuran-1-amine;N-dibenzothiophen-4-yl-8-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)dibenzothiophen-2-amine;N-(9,9-dimethylfluoren-1-yl)-N-[7-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]dibenzofuran-2-amine
CID 163616043
8-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)-N-(4-phenylphenyl)dibenzofuran-3-amine;N-phenyl-8-(9-phenylfluoren-9-yl)-N-(3-phenylphenyl)dibenzofuran-3-amine;N-phenyl-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzothiophen-2-amine
CID 163747382
8-N-dibenzofuran-3-yl-8-N-(9,9-dimethylfluoren-2-yl)-1-N,1-N-diphenyldibenzothiophene-1,8-diamine
CID 167309913
N-(9,9-dimethylfluoren-2-yl)-N-[4-[8-(9-phenylfluoren-9-yl)dibenzofuran-3-yl]phenyl]dibenzofuran-3-amine;N-phenyl-N-[4-[8-(9-phenylfluoren-9-yl)dibenzofuran-3-yl]phenyl]dibenzofuran-3-amine
CID 163494653
N-(9,9-dimethylfluoren-2-yl)-N-[4-[7-(9-phenylfluoren-9-yl)dibenzothiophen-3-yl]phenyl]dibenzofuran-3-amine;N,N-diphenyl-2-[7-(9-phenylfluoren-9-yl)dibenzofuran-1-yl]aniline;N-phenyl-3-[3-[8-(9-phenylfluoren-9-yl)dibenzofuran-1-yl]phenyl]-N-(4-phenylphenyl)aniline
CID 163589564
2-N-dibenzofuran-3-yl-9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenylfluorene-2,7-diamine;2-N-dibenzothiophen-3-yl-9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenylfluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-dinaphthalen-1-yl-7-N-phenyl-2-N-(4-phenylphenyl)fluorene-2,7-diamine;7-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N-(4-phenylphenyl)fluorene-2,7-diamine;9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;7-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N-(4-phenylphenyl)fluorene-2,7-diamine
CID 159611762
7-N-dibenzofuran-3-yl-9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N-(4-phenylphenyl)fluorene-2,7-diamine;7-N-dibenzothiophen-3-yl-9,9-dimethyl-2-N-naphthalen-1-yl-2-N-phenyl-7-N-(4-phenylphenyl)fluorene-2,7-diamine;9,9-dimethyl-2-N,7-N-diphenyl-2-N,7-N-bis(4-phenylphenyl)fluorene-2,7-diamine;2-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-2-N,7-N-diphenyl-7-N-(4-phenylphenyl)fluorene-2,7-diamine;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 157280557
9-(9-phenylfluoren-9-yl)-N,N-bis(4-phenylphenyl)dibenzofuran-2-amine;8-(9-phenylfluoren-9-yl)-N,N-bis(4-phenylphenyl)dibenzothiophen-3-amine;N-phenyl-N-(4-phenylphenyl)-8-[9-(4-phenylphenyl)fluoren-9-yl]dibenzofuran-1-amine
CID 163681079
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9'-spirobi[fluorene]-2-amine
CID 157349441
8-phenyl-N-(9-phenyldibenzothiophen-2-yl)-N-[3-[9-(4-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
CID 176759756

Frequently Asked Questions

What is the IUPAC name of N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine?
The IUPAC name of N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine (CID 163965802) is N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine.
What is the SMILES notation for N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine?
The canonical SMILES for N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4oc5ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc5c34)cc21.c1ccc(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3ccc4sc5ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc5c4c3)cc2)cc1.c1ccc(-c2cccc(N(c3ccc4c(c3)oc3ccccc34)c3cccc4sc5ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc5c34)c2)cc1.
What is the InChIKey of N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine?
The InChIKey is SLPZTFSTARDFEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H41NO.2C55H35NOS/c1-57(2)49-23-12-9-20-44(49)47-34-33-43(37-52(47)57)59(42-31-28-39(29-32-42)38-16-5-3-6-17-38)53-26-15-27-55-56(53)48-36-41(30-35-54(48)60-55)58(40-18-7-4-8-19-40)50-24-13-10-21-45(50)46-22-11-14-25-51(46)58;1-3-15-36(16-4-1)37-17-13-20-40(33-37)56(41-30-31-45-44-23-9-12-27-50(44)57-51(45)35-41)49-26-14-28-53-54(49)46-34-39(29-32-52(46)58-53)55(38-18-5-2-6-19-38)47-24-10-7-21-42(47)43-22-8-11-25-48(43)55;1-3-13-36(14-4-1)37-23-26-40(27-24-37)56(41-28-30-52-46(34-41)45-19-9-12-22-51(45)57-52)42-29-32-54-48(35-42)47-33-39(25-31-53(47)58-54)55(38-15-5-2-6-16-38)49-20-10-7-17-43(49)44-18-8-11-21-50(44)55/h3-37H,1-2H3;2*1-35H.
What are the key properties of N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine?
N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine has a molecular weight of 2283.89 g/mol, XLogP of 46.30, 18 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-dimethylfluoren-2-yl)-8-(9-phenylfluoren-9-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-1-yl]-N-(3-phenylphenyl)dibenzofuran-3-amine;N-[8-(9-phenylfluoren-9-yl)dibenzothiophen-2-yl]-N-(4-phenylphenyl)dibenzofuran-2-amine is sourced from PubChem (CID 163965802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).