2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine

C54H34N2O — CID 171760945

IUPAC2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine
SMILESc1ccc(-c2cccc3c2oc2c(-c4cc(-c5ccc(-c6ccc7ccccc7c6)nc5)cc(-c5ccc(-c6ccc7ccccc7c6)nc5)c4)cccc23)cc1
InChIInChI=1S/C54H34N2O/c1-2-12-37(13-3-1)47-16-8-18-49-50-19-9-17-48(54(50)57-53(47)49)46-31-44(42-24-26-51(55-33-42)40-22-20-35-10-4-6-14-38(35)28-40)30-45(32-46)43-25-27-52(56-34-43)41-23-21-36-11-5-7-15-39(36)29-41/h1-34H
InChIKeyZEGDAKONVQMYAP-UHFFFAOYSA-N
MW726.88 g/mol
LogP14.68
Rot. Bonds6

About 2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine

2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine (PubChem CID 171760945) has the molecular formula C54H34N2O and a molecular weight of 726.88 g/mol. Its IUPAC name is 2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine.

Molecular Properties

Compound Name2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine
PubChem CID171760945
Molecular FormulaC54H34N2O
Molecular Weight726.88 g/mol
Exact Mass726.27
IUPAC Name2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine
SMILESc1ccc(-c2cccc3c2oc2c(-c4cc(-c5ccc(-c6ccc7ccccc7c6)nc5)cc(-c5ccc(-c6ccc7ccccc7c6)nc5)c4)cccc23)cc1
InChIInChI=1S/C54H34N2O/c1-2-12-37(13-3-1)47-16-8-18-49-50-19-9-17-48(54(50)57-53(47)49)46-31-44(42-24-26-51(55-33-42)40-22-20-35-10-4-6-14-38(35)28-40)30-45(32-46)43-25-27-52(56-34-43)41-23-21-36-11-5-7-15-39(36)29-41/h1-34H
InChIKeyZEGDAKONVQMYAP-UHFFFAOYSA-N
XLogP14.68
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500726.88
LogP ≤ 514.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-5-[3-(6-phenyldibenzofuran-4-yl)-5-pyridin-3-ylphenyl]pyridine
CID 171760904
2-dibenzofuran-4-yl-5-naphthalen-2-ylpyridine
CID 171576906
4-phenyl-6-[7-(6-phenylnaphthalen-2-yl)pyren-2-yl]dibenzofuran
CID 174253549
6-[3,5-di(dibenzofuran-4-yl)phenyl]-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-[3,5-di(dibenzofuran-4-yl)phenyl]-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-[3,5-di(dibenzofuran-4-yl)phenyl]phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline;N-[4-[4-[3,5-di(dibenzofuran-4-yl)phenyl]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 158610709
5-(10-naphthalen-2-ylanthracen-9-yl)-2-[3-[5-(10-naphthalen-2-ylanthracen-9-yl)-2-pyridinyl]phenyl]pyridine
CID 174903865
5-[4-(6-isocyanodibenzofuran-4-yl)phenyl]-2-phenylpyridine
CID 171761037
2,6-diphenyl-4-[4-(6-phenyldibenzofuran-4-yl)phenyl]pyridine
CID 171761157
2,4-dinaphthalen-2-yl-6-[10-(4-phenylphenyl)naphtho[1,2-b][1]benzofuran-5-yl]-1,3,5-triazine
CID 176817925
4-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-6-naphthalen-2-yl-2-phenylpyrimidine
CID 121460850
4-(3-dibenzofuran-4-yl-5-naphthalen-2-ylphenyl)-6-phenyl-2-(3-phenylphenyl)pyrimidine
CID 171583506
4-(3-dibenzofuran-4-yl-5-naphthalen-2-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine
CID 171583085
2-dibenzofuran-4-yl-4-(3,5-dinaphthalen-2-ylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 130465875

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine?
The IUPAC name of 2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine (CID 171760945) is 2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine.
What is the SMILES notation for 2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine?
The canonical SMILES for 2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine is c1ccc(-c2cccc3c2oc2c(-c4cc(-c5ccc(-c6ccc7ccccc7c6)nc5)cc(-c5ccc(-c6ccc7ccccc7c6)nc5)c4)cccc23)cc1.
What is the InChIKey of 2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine?
The InChIKey is ZEGDAKONVQMYAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34N2O/c1-2-12-37(13-3-1)47-16-8-18-49-50-19-9-17-48(54(50)57-53(47)49)46-31-44(42-24-26-51(55-33-42)40-22-20-35-10-4-6-14-38(35)28-40)30-45(32-46)43-25-27-52(56-34-43)41-23-21-36-11-5-7-15-39(36)29-41/h1-34H.
What are the key properties of 2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine?
2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine has a molecular weight of 726.88 g/mol, XLogP of 14.68, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yl-5-[3-(6-naphthalen-2-yl-3-pyridinyl)-5-(6-phenyldibenzofuran-4-yl)phenyl]pyridine is sourced from PubChem (CID 171760945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).