4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine

C60H39NO — CID 177069697

IUPAC4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine
SMILESc1ccc(-c2ccccc2-c2ccccc2N(c2ccccc2-c2ccc3c4ccccc4c4ccccc4c3c2)c2ccc(-c3ccccc3)c3oc4ccccc4c23)cc1
InChIInChI=1S/C60H39NO/c1-3-19-40(20-4-1)43-23-7-8-25-46(43)52-30-14-17-33-56(52)61(57-38-37-45(41-21-5-2-6-22-41)60-59(57)53-31-15-18-34-58(53)62-60)55-32-16-13-24-44(55)42-35-36-51-49-28-10-9-26-47(49)48-27-11-12-29-50(48)54(51)39-42/h1-39H
InChIKeyOTIJMZYLLBJFIG-UHFFFAOYSA-N
MW789.98 g/mol
LogP17.18
Rot. Bonds7

About 4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine

4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine (PubChem CID 177069697) has the molecular formula C60H39NO and a molecular weight of 789.98 g/mol. Its IUPAC name is 4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine.

Molecular Properties

Compound Name4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine
PubChem CID177069697
Molecular FormulaC60H39NO
Molecular Weight789.98 g/mol
Exact Mass789.30
IUPAC Name4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine
SMILESc1ccc(-c2ccccc2-c2ccccc2N(c2ccccc2-c2ccc3c4ccccc4c4ccccc4c3c2)c2ccc(-c3ccccc3)c3oc4ccccc4c23)cc1
InChIInChI=1S/C60H39NO/c1-3-19-40(20-4-1)43-23-7-8-25-46(43)52-30-14-17-33-56(52)61(57-38-37-45(41-21-5-2-6-22-41)60-59(57)53-31-15-18-34-58(53)62-60)55-32-16-13-24-44(55)42-35-36-51-49-28-10-9-26-47(49)48-27-11-12-29-50(48)54(51)39-42/h1-39H
InChIKeyOTIJMZYLLBJFIG-UHFFFAOYSA-N
XLogP17.18
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500789.98
LogP ≤ 517.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-naphthalen-1-yl-N-[2-(4-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine
CID 177069796
4-naphthalen-2-yl-N-[3-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine
CID 177069190
4-phenyl-N-(4-phenylphenyl)-N-[2-[2-(2-phenyl-N-(2-phenylphenyl)anilino)phenyl]phenyl]dibenzofuran-1-amine
CID 167087184
4-naphthalen-2-yl-N-[2-(2-phenylphenyl)phenyl]-N-(3-triphenylen-2-ylphenyl)dibenzofuran-1-amine
CID 177069399
4-naphthalen-2-yl-N-[2-(3-phenylphenyl)phenyl]-N-(4-triphenylen-2-ylphenyl)dibenzofuran-1-amine
CID 177069453
N-(2-naphthalen-1-ylphenyl)-4-phenyl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069373
4-naphthalen-2-yl-N-(4-phenylphenyl)-N-[2-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069663
4-naphthalen-2-yl-N-(4-phenanthren-9-ylphenyl)-N-[2-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069864
N-(2,5-diphenylphenyl)-N-phenanthren-1-yl-4-(4-phenylphenyl)dibenzofuran-1-amine
CID 176820901
N-phenanthren-2-yl-N-(2-phenylphenyl)-4-(4-phenylphenyl)dibenzofuran-1-amine
CID 176820810
N-(2,4-diphenylphenyl)-4-phenanthren-9-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069217
4-phenanthren-9-yl-N-[2-(4-phenylphenyl)phenyl]-N-(3-triphenylen-2-ylphenyl)dibenzofuran-1-amine
CID 177069852

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine?
The IUPAC name of 4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine (CID 177069697) is 4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine.
What is the SMILES notation for 4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine?
The canonical SMILES for 4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine is c1ccc(-c2ccccc2-c2ccccc2N(c2ccccc2-c2ccc3c4ccccc4c4ccccc4c3c2)c2ccc(-c3ccccc3)c3oc4ccccc4c23)cc1.
What is the InChIKey of 4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine?
The InChIKey is OTIJMZYLLBJFIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H39NO/c1-3-19-40(20-4-1)43-23-7-8-25-46(43)52-30-14-17-33-56(52)61(57-38-37-45(41-21-5-2-6-22-41)60-59(57)53-31-15-18-34-58(53)62-60)55-32-16-13-24-44(55)42-35-36-51-49-28-10-9-26-47(49)48-27-11-12-29-50(48)54(51)39-42/h1-39H.
What are the key properties of 4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine?
4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine has a molecular weight of 789.98 g/mol, XLogP of 17.18, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-[2-(2-phenylphenyl)phenyl]-N-(2-triphenylen-2-ylphenyl)dibenzofuran-1-amine is sourced from PubChem (CID 177069697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).