N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine

C58H39NO — CID 172503187

IUPACN-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine
SMILESc1ccc(-c2ccc(-c3ccccc3-c3ccccc3N(c3ccc(-c4cccc5ccccc45)cc3)c3cccc4c3oc3ccccc34)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C58H39NO/c1-3-17-40(18-4-1)44-35-38-50(54(39-44)42-19-5-2-6-20-42)48-24-9-10-25-49(48)51-26-11-13-30-55(51)59(56-31-16-29-53-52-27-12-14-32-57(52)60-58(53)56)45-36-33-43(34-37-45)47-28-15-22-41-21-7-8-23-46(41)47/h1-39H
InChIKeyDLNPFFYFZKASRR-UHFFFAOYSA-N
MW765.96 g/mol
LogP16.54
Rot. Bonds8

About N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine

N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine (PubChem CID 172503187) has the molecular formula C58H39NO and a molecular weight of 765.96 g/mol. Its IUPAC name is N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine.

Molecular Properties

Compound NameN-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine
PubChem CID172503187
Molecular FormulaC58H39NO
Molecular Weight765.96 g/mol
Exact Mass765.30
IUPAC NameN-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine
SMILESc1ccc(-c2ccc(-c3ccccc3-c3ccccc3N(c3ccc(-c4cccc5ccccc45)cc3)c3cccc4c3oc3ccccc34)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C58H39NO/c1-3-17-40(18-4-1)44-35-38-50(54(39-44)42-19-5-2-6-20-42)48-24-9-10-25-49(48)51-26-11-13-30-55(51)59(56-31-16-29-53-52-27-12-14-32-57(52)60-58(53)56)45-36-33-43(34-37-45)47-28-15-22-41-21-7-8-23-46(41)47/h1-39H
InChIKeyDLNPFFYFZKASRR-UHFFFAOYSA-N
XLogP16.54
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500765.96
LogP ≤ 516.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(4-dibenzofuran-4-yl-3-phenylphenyl)phenyl]-N-naphthalen-1-ylnaphthalen-1-amine
CID 164832167
N-(4-dibenzofuran-4-ylphenyl)-2-[2-(2,4-diphenylphenyl)phenyl]-N-(3-naphthalen-1-ylphenyl)aniline
CID 172503073
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]dibenzofuran-4-amine
CID 168788827
N-[4-(2-phenylphenyl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-4-amine
CID 164744376
N-naphthalen-2-yl-N-[2-[5-phenyl-2-(2-phenylphenyl)phenyl]phenyl]dibenzofuran-4-amine
CID 172502504
2-(4-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline
CID 176763153
N-[4-(4-dibenzofuran-4-yl-3-phenylphenyl)phenyl]-N-(2,4-diphenylphenyl)-2,4-diphenylaniline
CID 164831971
N-[2-[3-[5-[10-[N-dibenzofuran-4-yl-2-(3-naphthalen-1-ylphenyl)anilino]triphenylen-2-yl]naphthalen-1-yl]phenyl]phenyl]-N-[4-(3-phenylphenyl)phenyl]dibenzofuran-4-amine
CID 170014571
N-(2-dibenzofuran-4-ylphenyl)-N-[4-(2,4-diphenylphenyl)phenyl]naphtho[1,2-b][1]benzofuran-7-amine
CID 171738107
N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-4-amine
CID 166566139
N-(2-dibenzofuran-4-ylphenyl)-2-[2-(2-phenylphenyl)phenyl]-N-[4-(3-phenylphenyl)phenyl]aniline
CID 172502136
N-(4-naphthalen-1-ylphenyl)-N-(2-phenylphenyl)naphtho[1,2-b][1]benzofuran-4-amine
CID 167277315

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine?
The IUPAC name of N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine (CID 172503187) is N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine.
What is the SMILES notation for N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine?
The canonical SMILES for N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine is c1ccc(-c2ccc(-c3ccccc3-c3ccccc3N(c3ccc(-c4cccc5ccccc45)cc3)c3cccc4c3oc3ccccc34)c(-c3ccccc3)c2)cc1.
What is the InChIKey of N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine?
The InChIKey is DLNPFFYFZKASRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H39NO/c1-3-17-40(18-4-1)44-35-38-50(54(39-44)42-19-5-2-6-20-42)48-24-9-10-25-49(48)51-26-11-13-30-55(51)59(56-31-16-29-53-52-27-12-14-32-57(52)60-58(53)56)45-36-33-43(34-37-45)47-28-15-22-41-21-7-8-23-46(41)47/h1-39H.
What are the key properties of N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine?
N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine has a molecular weight of 765.96 g/mol, XLogP of 16.54, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2,4-diphenylphenyl)phenyl]phenyl]-N-(4-naphthalen-1-ylphenyl)dibenzofuran-4-amine is sourced from PubChem (CID 172503187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).