9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine

C183H126N6O3 — CID 157051300

IUPAC9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine
SMILES[2H]c1c([2H])c([2H])c(C2(c3ccc4oc5ccccc5c4c3)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccccc4-c4ccccc4)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4c3oc3ccccc34)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4oc5ccccc5c34)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccccc4-c4ccccc4)ccc32)c([2H])c1[2H]
InChIInChI=1S/3C61H42N2O/c1-6-21-43(22-7-1)50-31-16-18-34-57(50)63(47-29-14-5-15-30-47)49-38-40-55-53(42-49)52-41-48(62(45-25-10-3-11-26-45)46-27-12-4-13-28-46)37-39-54(52)61(55,44-23-8-2-9-24-44)56-33-20-36-59-60(56)51-32-17-19-35-58(51)64-59;1-6-20-43(21-7-1)51-30-16-18-32-58(51)63(48-28-14-5-15-29-48)50-36-38-57-54(42-50)53-41-49(62(46-24-10-3-11-25-46)47-26-12-4-13-27-47)35-37-56(53)61(57,44-22-8-2-9-23-44)45-34-39-60-55(40-45)52-31-17-19-33-59(52)64-60;1-6-19-43(20-7-1)44-33-35-49(36-34-44)63(48-27-14-5-15-28-48)51-38-40-57-55(42-51)54-41-50(62(46-23-10-3-11-24-46)47-25-12-4-13-26-47)37-39-56(54)61(57,45-21-8-2-9-22-45)58-31-18-30-53-52-29-16-17-32-59(52)64-60(53)58/h3*1-42H/i2D,8D,9D,23D,24D;2D,8D,9D,22D,23D;2D,8D,9D,21D,22D
InChIKeyAAFVWYPQQIZKSZ-FVCJTLBOSA-N
MW2472.15 g/mol
LogP49.67
Rot. Bonds27

About 9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine

9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine (PubChem CID 157051300) has the molecular formula C183H126N6O3 and a molecular weight of 2472.15 g/mol. Its IUPAC name is 9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine.

Molecular Properties

Compound Name9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine
PubChem CID157051300
Molecular FormulaC183H126N6O3
Molecular Weight2472.15 g/mol
Exact Mass2470.08
IUPAC Name9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine
SMILES[2H]c1c([2H])c([2H])c(C2(c3ccc4oc5ccccc5c4c3)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccccc4-c4ccccc4)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4c3oc3ccccc34)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4oc5ccccc5c34)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccccc4-c4ccccc4)ccc32)c([2H])c1[2H]
InChIInChI=1S/3C61H42N2O/c1-6-21-43(22-7-1)50-31-16-18-34-57(50)63(47-29-14-5-15-30-47)49-38-40-55-53(42-49)52-41-48(62(45-25-10-3-11-26-45)46-27-12-4-13-28-46)37-39-54(52)61(55,44-23-8-2-9-24-44)56-33-20-36-59-60(56)51-32-17-19-35-58(51)64-59;1-6-20-43(21-7-1)51-30-16-18-32-58(51)63(48-28-14-5-15-29-48)50-36-38-57-54(42-50)53-41-49(62(46-24-10-3-11-25-46)47-26-12-4-13-27-47)35-37-56(53)61(57,44-22-8-2-9-23-44)45-34-39-60-55(40-45)52-31-17-19-33-59(52)64-60;1-6-19-43(20-7-1)44-33-35-49(36-34-44)63(48-27-14-5-15-28-48)51-38-40-57-55(42-51)54-41-50(62(46-23-10-3-11-24-46)47-25-12-4-13-26-47)37-39-56(54)61(57,45-21-8-2-9-22-45)58-31-18-30-53-52-29-16-17-32-59(52)64-60(53)58/h3*1-42H/i2D,8D,9D,23D,24D;2D,8D,9D,22D,23D;2D,8D,9D,21D,22D
InChIKeyAAFVWYPQQIZKSZ-FVCJTLBOSA-N
XLogP49.67
TPSA58.86 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds27
Heavy Atoms192
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002472.15
LogP ≤ 549.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine with MolForge

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Related Compounds

9-dibenzofuran-1-yl-3-N-naphthalen-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenylfluorene-3,6-diamine;9-dibenzofuran-3-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine
CID 159248377
9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine
CID 156687617
9-dibenzofuran-1-yl-9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine
CID 156687341
9-dibenzofuran-3-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine
CID 156687405
3-N-dibenzofuran-2-yl-3-N-(9,9-diphenylfluoren-3-yl)-1-N-phenyl-1-N-[3-(9-phenylfluoren-9-yl)phenyl]benzene-1,3-diamine;3-N-dibenzofuran-3-yl-1-N-phenyl-1-N-[3-(9-phenylfluoren-9-yl)phenyl]-3-N-(2-phenylphenyl)benzene-1,3-diamine;3-N-dibenzofuran-3-yl-1-N-phenyl-1-N-[3-(9-phenylfluoren-9-yl)phenyl]-3-N-(4-phenylphenyl)benzene-1,3-diamine
CID 157167545
9-dibenzofuran-1-yl-9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N-naphthalen-2-yl-N-phenylfluoren-3-amine;9-dibenzofuran-3-yl-9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N-naphthalen-1-yl-N-phenylfluoren-3-amine;9-dibenzofuran-4-yl-9-(2,3,4,5,6,7,8-heptadeuterionaphthalen-1-yl)-N-naphthalen-1-yl-N-phenylfluoren-3-amine
CID 158176424
N-[4-(9,9-diphenylfluoren-3-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine;N-[3-(9,9-diphenylfluoren-3-yl)phenyl]-2-phenyl-N-(3-phenylphenyl)aniline;N-[4-(9,9-diphenylfluoren-3-yl)phenyl]-3-phenyl-N-(4-phenylphenyl)aniline
CID 159727177
3-N-dibenzofuran-4-yl-2-N'-(2,3,4,5,6-pentadeuteriophenyl)-2-N',3-N-diphenyl-9,9'-spirobi[fluorene]-2',3-diamine
CID 168791333
N-dibenzofuran-1-yl-N-phenyl-6-(9-phenylfluoren-9-yl)dibenzofuran-2-amine;N,N-diphenyl-6-(9-phenylfluoren-9-yl)dibenzofuran-2-amine;methane;N-naphthalen-1-yl-N-phenyl-6-(9-phenylfluoren-9-yl)dibenzofuran-2-amine;N-phenyl-6-(9-phenylfluoren-9-yl)-N-(2-phenylphenyl)dibenzofuran-2-amine
CID 159290929
N,N-diphenyl-2-[7-(9-phenylfluoren-9-yl)dibenzofuran-4-yl]aniline;N,N-diphenyl-4-[3-[7-(9-phenylfluoren-9-yl)dibenzofuran-1-yl]phenyl]aniline;N-phenyl-3-[8-(9-phenylfluoren-9-yl)dibenzofuran-3-yl]-N-(4-phenylphenyl)aniline
CID 163690890
N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-9,9-diphenylfluoren-3-amine
CID 121425114
N-(4-dibenzofuran-4-ylphenyl)-2-[3-(9,9-diphenylfluoren-3-yl)phenyl]-N-(3-phenylphenyl)aniline
CID 168839801

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine?
The IUPAC name of 9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine (CID 157051300) is 9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine.
What is the SMILES notation for 9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine?
The canonical SMILES for 9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine is [2H]c1c([2H])c([2H])c(C2(c3ccc4oc5ccccc5c4c3)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccccc4-c4ccccc4)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4c3oc3ccccc34)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)ccc32)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(C2(c3cccc4oc5ccccc5c34)c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccccc4-c4ccccc4)ccc32)c([2H])c1[2H].
What is the InChIKey of 9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine?
The InChIKey is AAFVWYPQQIZKSZ-FVCJTLBOSA-N. The full InChI is InChI=1S/3C61H42N2O/c1-6-21-43(22-7-1)50-31-16-18-34-57(50)63(47-29-14-5-15-30-47)49-38-40-55-53(42-49)52-41-48(62(45-25-10-3-11-26-45)46-27-12-4-13-28-46)37-39-54(52)61(55,44-23-8-2-9-24-44)56-33-20-36-59-60(56)51-32-17-19-35-58(51)64-59;1-6-20-43(21-7-1)51-30-16-18-32-58(51)63(48-28-14-5-15-29-48)50-36-38-57-54(42-50)53-41-49(62(46-24-10-3-11-25-46)47-26-12-4-13-27-47)35-37-56(53)61(57,44-22-8-2-9-23-44)45-34-39-60-55(40-45)52-31-17-19-33-59(52)64-60;1-6-19-43(20-7-1)44-33-35-49(36-34-44)63(48-27-14-5-15-28-48)51-38-40-57-55(42-51)54-41-50(62(46-23-10-3-11-24-46)47-25-12-4-13-26-47)37-39-56(54)61(57,45-21-8-2-9-22-45)58-31-18-30-53-52-29-16-17-32-59(52)64-60(53)58/h3*1-42H/i2D,8D,9D,23D,24D;2D,8D,9D,22D,23D;2D,8D,9D,21D,22D.
What are the key properties of 9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine?
9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine has a molecular weight of 2472.15 g/mol, XLogP of 49.67, 27 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 9-dibenzofuran-1-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-2-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(2-phenylphenyl)fluorene-3,6-diamine;9-dibenzofuran-4-yl-9-(2,3,4,5,6-pentadeuteriophenyl)-3-N,6-N,6-N-triphenyl-3-N-(4-phenylphenyl)fluorene-3,6-diamine is sourced from PubChem (CID 157051300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).