7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine

C156H114N4O3 — CID 157365296

IUPAC7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)c3ccc4c(c3)C(C)(C)c3cc(-c5cccc6c5oc5ccccc56)ccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21
InChIInChI=1S/C60H43NO2.C51H37NO.C45H34N2/c1-59(2)51-17-8-5-12-43(51)45-29-26-40(34-53(45)59)61(39-24-20-36(21-25-39)37-23-31-57-50(32-37)48-14-7-9-18-55(48)62-57)41-27-30-46-44-28-22-38(33-52(44)60(3,4)54(46)35-41)42-15-11-16-49-47-13-6-10-19-56(47)63-58(42)49;1-51(2)47-17-8-6-13-43(47)44-32-25-38(33-48(44)51)36-21-28-40(29-22-36)52(39-26-19-35(20-27-39)34-11-4-3-5-12-34)41-30-23-37(24-31-41)42-15-10-16-46-45-14-7-9-18-49(45)53-50(42)46;1-45(2)41-19-11-9-17-37(41)38-27-25-36(30-42(38)45)46(34-23-21-32(22-24-34)31-13-5-3-6-14-31)35-26-28-44-40(29-35)39-18-10-12-20-43(39)47(44)33-15-7-4-8-16-33/h5-35H,1-4H3;3-33H,1-2H3;3-30H,1-2H3
InChIKeyBJCKQJPYPAGBHL-UHFFFAOYSA-N
MW2092.65 g/mol
LogP43.49
Rot. Bonds16

About 7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine

7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine (PubChem CID 157365296) has the molecular formula C156H114N4O3 and a molecular weight of 2092.65 g/mol. Its IUPAC name is 7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine.

Molecular Properties

Compound Name7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
PubChem CID157365296
Molecular FormulaC156H114N4O3
Molecular Weight2092.65 g/mol
Exact Mass2090.89
IUPAC Name7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)c3ccc4c(c3)C(C)(C)c3cc(-c5cccc6c5oc5ccccc56)ccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21
InChIInChI=1S/C60H43NO2.C51H37NO.C45H34N2/c1-59(2)51-17-8-5-12-43(51)45-29-26-40(34-53(45)59)61(39-24-20-36(21-25-39)37-23-31-57-50(32-37)48-14-7-9-18-55(48)62-57)41-27-30-46-44-28-22-38(33-52(44)60(3,4)54(46)35-41)42-15-11-16-49-47-13-6-10-19-56(47)63-58(42)49;1-51(2)47-17-8-6-13-43(47)44-32-25-38(33-48(44)51)36-21-28-40(29-22-36)52(39-26-19-35(20-27-39)34-11-4-3-5-12-34)41-30-23-37(24-31-41)42-15-10-16-46-45-14-7-9-18-49(45)53-50(42)46;1-45(2)41-19-11-9-17-37(41)38-27-25-36(30-42(38)45)46(34-23-21-32(22-24-34)31-13-5-3-6-14-31)35-26-28-44-40(29-35)39-18-10-12-20-43(39)47(44)33-15-7-4-8-16-33/h5-35H,1-4H3;3-33H,1-2H3;3-30H,1-2H3
InChIKeyBJCKQJPYPAGBHL-UHFFFAOYSA-N
XLogP43.49
TPSA54.07 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms163
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002092.65
LogP ≤ 543.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine?
The IUPAC name of 7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine (CID 157365296) is 7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine.
What is the SMILES notation for 7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine?
The canonical SMILES for 7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine is CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5oc6ccccc6c5c4)cc3)c3ccc4c(c3)C(C)(C)c3cc(-c5cccc6c5oc5ccccc56)ccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21.
What is the InChIKey of 7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine?
The InChIKey is BJCKQJPYPAGBHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H43NO2.C51H37NO.C45H34N2/c1-59(2)51-17-8-5-12-43(51)45-29-26-40(34-53(45)59)61(39-24-20-36(21-25-39)37-23-31-57-50(32-37)48-14-7-9-18-55(48)62-57)41-27-30-46-44-28-22-38(33-52(44)60(3,4)54(46)35-41)42-15-11-16-49-47-13-6-10-19-56(47)63-58(42)49;1-51(2)47-17-8-6-13-43(47)44-32-25-38(33-48(44)51)36-21-28-40(29-22-36)52(39-26-19-35(20-27-39)34-11-4-3-5-12-34)41-30-23-37(24-31-41)42-15-10-16-46-45-14-7-9-18-49(45)53-50(42)46;1-45(2)41-19-11-9-17-37(41)38-27-25-36(30-42(38)45)46(34-23-21-32(22-24-34)31-13-5-3-6-14-31)35-26-28-44-40(29-35)39-18-10-12-20-43(39)47(44)33-15-7-4-8-16-33/h5-35H,1-4H3;3-33H,1-2H3;3-30H,1-2H3.
What are the key properties of 7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine?
7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine has a molecular weight of 2092.65 g/mol, XLogP of 43.49, 16 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-dibenzofuran-4-yl-N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-phenylaniline;N-(9,9-dimethylfluoren-2-yl)-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine is sourced from PubChem (CID 157365296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).