4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline

C68H43NO2 — CID 88950712

IUPAC4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline
SMILESc1ccc2cc(-c3cc(-c4ccc(N(c5ccc(-c6cccc7c6oc6ccccc67)cc5)c5ccc(-c6cccc7c6oc6ccccc67)cc5)cc4)cc(-c4ccc5ccccc5c4)c3)ccc2c1
InChIInChI=1S/C68H43NO2/c1-3-13-49-39-51(25-23-44(49)11-1)54-41-53(42-55(43-54)52-26-24-45-12-2-4-14-50(45)40-52)46-27-33-56(34-28-46)69(57-35-29-47(30-36-57)59-17-9-19-63-61-15-5-7-21-65(61)70-67(59)63)58-37-31-48(32-38-58)60-18-10-20-64-62-16-6-8-22-66(62)71-68(60)64/h1-43H
InChIKeyIPNBQVMOCORLCN-UHFFFAOYSA-N
MW906.10 g/mol
LogP19.60
Rot. Bonds8

About 4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline

4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline (PubChem CID 88950712) has the molecular formula C68H43NO2 and a molecular weight of 906.10 g/mol. Its IUPAC name is 4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline.

Molecular Properties

Compound Name4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline
PubChem CID88950712
Molecular FormulaC68H43NO2
Molecular Weight906.10 g/mol
Exact Mass905.33
IUPAC Name4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline
SMILESc1ccc2cc(-c3cc(-c4ccc(N(c5ccc(-c6cccc7c6oc6ccccc67)cc5)c5ccc(-c6cccc7c6oc6ccccc67)cc5)cc4)cc(-c4ccc5ccccc5c4)c3)ccc2c1
InChIInChI=1S/C68H43NO2/c1-3-13-49-39-51(25-23-44(49)11-1)54-41-53(42-55(43-54)52-26-24-45-12-2-4-14-50(45)40-52)46-27-33-56(34-28-46)69(57-35-29-47(30-36-57)59-17-9-19-63-61-15-5-7-21-65(61)70-67(59)63)58-37-31-48(32-38-58)60-18-10-20-64-62-16-6-8-22-66(62)71-68(60)64/h1-43H
InChIKeyIPNBQVMOCORLCN-UHFFFAOYSA-N
XLogP19.60
TPSA29.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms71
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500906.10
LogP ≤ 519.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline 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

N-(4-dibenzofuran-4-ylphenyl)-4-(3-naphthalen-2-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 155374400
N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-3-[4-(3-naphthalen-2-ylphenyl)phenyl]aniline
CID 167358323
N-(4-dibenzofuran-1-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-4-[4-(3-naphthalen-2-ylphenyl)phenyl]aniline
CID 166566033
3-N-(4-dibenzofuran-4-ylphenyl)-5-naphthalen-2-yl-1-N,1-N,3-N-tris(4-phenylphenyl)benzene-1,3-diamine
CID 162770461
N-(4-dibenzofuran-4-ylphenyl)-N,3-bis(4-naphthalen-2-ylphenyl)aniline
CID 155374297
N-(4-dibenzofuran-4-ylphenyl)-N,3-bis(3-naphthalen-2-ylphenyl)aniline
CID 155374464
4-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-2-ylphenyl)aniline
CID 58510830
N-(4-dibenzofuran-4-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]phenanthren-3-amine
CID 155119902
N-(4-dibenzofuran-4-ylphenyl)-4-naphthalen-2-yl-N-[4-(6-phenyldibenzofuran-2-yl)phenyl]aniline
CID 168805171
N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-3-[4-(2-naphthalen-2-ylphenyl)phenyl]aniline
CID 155374301
N-[4-[3,5-di(dibenzofuran-4-yl)phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121383293
N-(4-dibenzofuran-4-ylphenyl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 118405762

Frequently Asked Questions

What is the IUPAC name of 4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline?
The IUPAC name of 4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline (CID 88950712) is 4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline.
What is the SMILES notation for 4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline?
The canonical SMILES for 4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline is c1ccc2cc(-c3cc(-c4ccc(N(c5ccc(-c6cccc7c6oc6ccccc67)cc5)c5ccc(-c6cccc7c6oc6ccccc67)cc5)cc4)cc(-c4ccc5ccccc5c4)c3)ccc2c1.
What is the InChIKey of 4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline?
The InChIKey is IPNBQVMOCORLCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H43NO2/c1-3-13-49-39-51(25-23-44(49)11-1)54-41-53(42-55(43-54)52-26-24-45-12-2-4-14-50(45)40-52)46-27-33-56(34-28-46)69(57-35-29-47(30-36-57)59-17-9-19-63-61-15-5-7-21-65(61)70-67(59)63)58-37-31-48(32-38-58)60-18-10-20-64-62-16-6-8-22-66(62)71-68(60)64/h1-43H.
What are the key properties of 4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline?
4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline has a molecular weight of 906.10 g/mol, XLogP of 19.60, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-dinaphthalen-2-ylphenyl)phenyl]aniline is sourced from PubChem (CID 88950712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).