4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline

C160H113N3O3 — CID 160529998

IUPAC4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline
SMILESCc1cc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-c5cccc6ccccc56)cc4)cc3)cc2)c2oc3ccccc3c2c1.Cc1cc(-c2ccccc2)ccc1N(c1ccc(-c2cccc3c2oc2ccccc23)cc1)c1ccc(-c2ccc(-c3cccc4ccccc34)cc2)cc1C.Cc1cc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccc(-c4cccc5ccccc45)cc3)cc2)ccc1-c1cccc2c1oc1ccccc12
InChIInChI=1S/C54H39NO.2C53H37NO/c1-36-34-43(38-12-4-3-5-13-38)28-32-51(36)55(45-30-26-42(27-31-45)48-19-11-20-50-49-17-8-9-21-53(49)56-54(48)50)52-33-29-44(35-37(52)2)39-22-24-41(25-23-39)47-18-10-15-40-14-6-7-16-46(40)47;1-36-35-45(33-34-46(36)50-18-10-19-51-49-16-7-8-20-52(49)55-53(50)51)54(43-29-25-39(26-30-43)37-11-3-2-4-12-37)44-31-27-40(28-32-44)38-21-23-42(24-22-38)48-17-9-14-41-13-5-6-15-47(41)48;1-36-34-50(53-51(35-36)49-15-7-8-17-52(49)55-53)43-26-32-46(33-27-43)54(44-28-22-39(23-29-44)37-10-3-2-4-11-37)45-30-24-40(25-31-45)38-18-20-42(21-19-38)48-16-9-13-41-12-5-6-14-47(41)48/h3-35H,1-2H3;2*2-35H,1H3
InChIKeyQVKJPHARPDNXJR-UHFFFAOYSA-N
MW2125.68 g/mol
LogP45.86
Rot. Bonds21

About 4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline

4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline (PubChem CID 160529998) has the molecular formula C160H113N3O3 and a molecular weight of 2125.68 g/mol. Its IUPAC name is 4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline.

Molecular Properties

Compound Name4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline
PubChem CID160529998
Molecular FormulaC160H113N3O3
Molecular Weight2125.68 g/mol
Exact Mass2123.88
IUPAC Name4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline
SMILESCc1cc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-c5cccc6ccccc56)cc4)cc3)cc2)c2oc3ccccc3c2c1.Cc1cc(-c2ccccc2)ccc1N(c1ccc(-c2cccc3c2oc2ccccc23)cc1)c1ccc(-c2ccc(-c3cccc4ccccc34)cc2)cc1C.Cc1cc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccc(-c4cccc5ccccc45)cc3)cc2)ccc1-c1cccc2c1oc1ccccc12
InChIInChI=1S/C54H39NO.2C53H37NO/c1-36-34-43(38-12-4-3-5-13-38)28-32-51(36)55(45-30-26-42(27-31-45)48-19-11-20-50-49-17-8-9-21-53(49)56-54(48)50)52-33-29-44(35-37(52)2)39-22-24-41(25-23-39)47-18-10-15-40-14-6-7-16-46(40)47;1-36-35-45(33-34-46(36)50-18-10-19-51-49-16-7-8-20-52(49)55-53(50)51)54(43-29-25-39(26-30-43)37-11-3-2-4-12-37)44-31-27-40(28-32-44)38-21-23-42(24-22-38)48-17-9-14-41-13-5-6-15-47(41)48;1-36-34-50(53-51(35-36)49-15-7-8-17-52(49)55-53)43-26-32-46(33-27-43)54(44-28-22-39(23-29-44)37-10-3-2-4-11-37)45-30-24-40(25-31-45)38-18-20-42(21-19-38)48-16-9-13-41-12-5-6-14-47(41)48/h3-35H,1-2H3;2*2-35H,1H3
InChIKeyQVKJPHARPDNXJR-UHFFFAOYSA-N
XLogP45.86
TPSA49.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds21
Heavy Atoms166
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002125.68
LogP ≤ 545.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline?
The IUPAC name of 4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline (CID 160529998) is 4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline.
What is the SMILES notation for 4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline?
The canonical SMILES for 4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline is Cc1cc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-c5cccc6ccccc56)cc4)cc3)cc2)c2oc3ccccc3c2c1.Cc1cc(-c2ccccc2)ccc1N(c1ccc(-c2cccc3c2oc2ccccc23)cc1)c1ccc(-c2ccc(-c3cccc4ccccc34)cc2)cc1C.Cc1cc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccc(-c4cccc5ccccc45)cc3)cc2)ccc1-c1cccc2c1oc1ccccc12.
What is the InChIKey of 4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline?
The InChIKey is QVKJPHARPDNXJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H39NO.2C53H37NO/c1-36-34-43(38-12-4-3-5-13-38)28-32-51(36)55(45-30-26-42(27-31-45)48-19-11-20-50-49-17-8-9-21-53(49)56-54(48)50)52-33-29-44(35-37(52)2)39-22-24-41(25-23-39)47-18-10-15-40-14-6-7-16-46(40)47;1-36-35-45(33-34-46(36)50-18-10-19-51-49-16-7-8-20-52(49)55-53(50)51)54(43-29-25-39(26-30-43)37-11-3-2-4-12-37)44-31-27-40(28-32-44)38-21-23-42(24-22-38)48-17-9-14-41-13-5-6-15-47(41)48;1-36-34-50(53-51(35-36)49-15-7-8-17-52(49)55-53)43-26-32-46(33-27-43)54(44-28-22-39(23-29-44)37-10-3-2-4-11-37)45-30-24-40(25-31-45)38-18-20-42(21-19-38)48-16-9-13-41-12-5-6-14-47(41)48/h3-35H,1-2H3;2*2-35H,1H3.
What are the key properties of 4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline?
4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline has a molecular weight of 2125.68 g/mol, XLogP of 45.86, 21 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzofuran-4-yl-3-methyl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-(4-phenylphenyl)aniline;N-(4-dibenzofuran-4-ylphenyl)-2-methyl-N-[2-methyl-4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline;N-[4-(2-methyldibenzofuran-4-yl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-4-phenylaniline is sourced from PubChem (CID 160529998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).