4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine

C48H33NO — CID 177069608

IUPAC4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
SMILESc1ccc(-c2cccc(-c3cccc(N(c4cccc(-c5ccccc5)c4)c4ccc(-c5ccccc5)c5oc6ccccc6c45)c3)c2)cc1
InChIInChI=1S/C48H33NO/c1-4-15-34(16-5-1)37-21-12-22-38(31-37)40-24-14-26-42(33-40)49(41-25-13-23-39(32-41)35-17-6-2-7-18-35)45-30-29-43(36-19-8-3-9-20-36)48-47(45)44-27-10-11-28-46(44)50-48/h1-33H
InChIKeyRSJJYNMCFOYCDN-UHFFFAOYSA-N
MW639.80 g/mol
LogP13.72
Rot. Bonds7

About 4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine

4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine (PubChem CID 177069608) has the molecular formula C48H33NO and a molecular weight of 639.80 g/mol. Its IUPAC name is 4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine.

Molecular Properties

Compound Name4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
PubChem CID177069608
Molecular FormulaC48H33NO
Molecular Weight639.80 g/mol
Exact Mass639.26
IUPAC Name4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
SMILESc1ccc(-c2cccc(-c3cccc(N(c4cccc(-c5ccccc5)c4)c4ccc(-c5ccccc5)c5oc6ccccc6c45)c3)c2)cc1
InChIInChI=1S/C48H33NO/c1-4-15-34(16-5-1)37-21-12-22-38(31-37)40-24-14-26-42(33-40)49(41-25-13-23-39(32-41)35-17-6-2-7-18-35)45-30-29-43(36-19-8-3-9-20-36)48-47(45)44-27-10-11-28-46(44)50-48/h1-33H
InChIKeyRSJJYNMCFOYCDN-UHFFFAOYSA-N
XLogP13.72
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500639.80
LogP ≤ 513.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-phenyl-N-(2-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069333
N-(3-phenanthren-9-ylphenyl)-4-phenyl-N-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069616
N-phenanthren-2-yl-N-(3-phenylphenyl)-4-(4-phenylphenyl)dibenzofuran-1-amine
CID 176821033
4-naphthalen-2-yl-N-(3-phenylphenyl)-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069783
4-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069623
N-(4-naphthalen-2-ylphenyl)-4-phenyl-N-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069839
N-phenanthren-9-yl-4-phenyl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069460
4-naphthalen-2-yl-N-[3-(3-phenylphenyl)phenyl]-N-(3-triphenylen-2-ylphenyl)dibenzofuran-1-amine
CID 177069229
4-naphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069338
N-[4-(3-naphthalen-1-ylphenyl)phenyl]-4-phenyl-N-[4-[2-(4-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 168848045
N-[4-(3-naphthalen-1-ylphenyl)phenyl]-4-phenyl-N-[4-[2-(3-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 168847695
4-naphthalen-1-yl-N-(3-naphthalen-2-ylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069895

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine?
The IUPAC name of 4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine (CID 177069608) is 4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine.
What is the SMILES notation for 4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine?
The canonical SMILES for 4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine is c1ccc(-c2cccc(-c3cccc(N(c4cccc(-c5ccccc5)c4)c4ccc(-c5ccccc5)c5oc6ccccc6c45)c3)c2)cc1.
What is the InChIKey of 4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine?
The InChIKey is RSJJYNMCFOYCDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H33NO/c1-4-15-34(16-5-1)37-21-12-22-38(31-37)40-24-14-26-42(33-40)49(41-25-13-23-39(32-41)35-17-6-2-7-18-35)45-30-29-43(36-19-8-3-9-20-36)48-47(45)44-27-10-11-28-46(44)50-48/h1-33H.
What are the key properties of 4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine?
4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine has a molecular weight of 639.80 g/mol, XLogP of 13.72, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine is sourced from PubChem (CID 177069608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).