4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine

C52H35NO — CID 177069748

IUPAC4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
SMILESc1ccc(-c2ccccc2-c2cccc(N(c3ccccc3-c3ccccc3)c3ccc(-c4cccc5ccccc45)c4oc5ccccc5c34)c2)cc1
InChIInChI=1S/C52H35NO/c1-3-17-36(18-4-1)41-25-9-10-27-43(41)39-23-15-24-40(35-39)53(48-31-13-11-28-44(48)38-19-5-2-6-20-38)49-34-33-46(45-30-16-22-37-21-7-8-26-42(37)45)52-51(49)47-29-12-14-32-50(47)54-52/h1-35H
InChIKeyFDBBRCRVIZCPAN-UHFFFAOYSA-N
MW689.86 g/mol
LogP14.88
Rot. Bonds7

About 4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine

4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine (PubChem CID 177069748) has the molecular formula C52H35NO and a molecular weight of 689.86 g/mol. Its IUPAC name is 4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine.

Molecular Properties

Compound Name4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
PubChem CID177069748
Molecular FormulaC52H35NO
Molecular Weight689.86 g/mol
Exact Mass689.27
IUPAC Name4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
SMILESc1ccc(-c2ccccc2-c2cccc(N(c3ccccc3-c3ccccc3)c3ccc(-c4cccc5ccccc45)c4oc5ccccc5c34)c2)cc1
InChIInChI=1S/C52H35NO/c1-3-17-36(18-4-1)41-25-9-10-27-43(41)39-23-15-24-40(35-39)53(48-31-13-11-28-44(48)38-19-5-2-6-20-38)49-34-33-46(45-30-16-22-37-21-7-8-26-42(37)45)52-51(49)47-29-12-14-32-50(47)54-52/h1-35H
InChIKeyFDBBRCRVIZCPAN-UHFFFAOYSA-N
XLogP14.88
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500689.86
LogP ≤ 514.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-naphthalen-1-yl-N-(3-naphthalen-1-ylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069623
4-phenyl-N-(2-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069333
4-naphthalen-2-yl-N-(3-naphthalen-2-ylphenyl)-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069277
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
N-(2-naphthalen-1-ylphenyl)-4-phenyl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069373
4-naphthalen-2-yl-N-(3-naphthalen-1-ylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069235
4-naphthalen-1-yl-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-[2-(4-phenylphenyl)phenyl]phenyl]dibenzofuran-1-amine
CID 168848086
2-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[3-(2-naphthalen-1-ylphenyl)phenyl]aniline
CID 167325834
4-phenanthren-9-yl-N-[2-(4-phenylphenyl)phenyl]-N-(3-triphenylen-2-ylphenyl)dibenzofuran-1-amine
CID 177069852
4-naphthalen-2-yl-N-[2-(2-phenylphenyl)phenyl]-N-(3-triphenylen-2-ylphenyl)dibenzofuran-1-amine
CID 177069399
4-phenanthren-9-yl-N-(4-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 177069305

Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine?
The IUPAC name of 4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine (CID 177069748) is 4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine.
What is the SMILES notation for 4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine?
The canonical SMILES for 4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine is c1ccc(-c2ccccc2-c2cccc(N(c3ccccc3-c3ccccc3)c3ccc(-c4cccc5ccccc45)c4oc5ccccc5c34)c2)cc1.
What is the InChIKey of 4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine?
The InChIKey is FDBBRCRVIZCPAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H35NO/c1-3-17-36(18-4-1)41-25-9-10-27-43(41)39-23-15-24-40(35-39)53(48-31-13-11-28-44(48)38-19-5-2-6-20-38)49-34-33-46(45-30-16-22-37-21-7-8-26-42(37)45)52-51(49)47-29-12-14-32-50(47)54-52/h1-35H.
What are the key properties of 4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine?
4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine has a molecular weight of 689.86 g/mol, XLogP of 14.88, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-1-yl-N-(2-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]dibenzofuran-1-amine is sourced from PubChem (CID 177069748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).