5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole

C20H14N2O — CID 135057630

IUPAC5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole
SMILESc1ccc(-c2cnc(-c3ccccc3-c3ccccn3)o2)cc1
InChIInChI=1S/C20H14N2O/c1-2-8-15(9-3-1)19-14-22-20(23-19)17-11-5-4-10-16(17)18-12-6-7-13-21-18/h1-14H
InChIKeyMMGKLIQEORFXQG-UHFFFAOYSA-N
MW298.35 g/mol
LogP5.07
Rot. Bonds3

About 5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole

5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole (PubChem CID 135057630) has the molecular formula C20H14N2O and a molecular weight of 298.35 g/mol. Its IUPAC name is 5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole.

Molecular Properties

Compound Name5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole
PubChem CID135057630
Molecular FormulaC20H14N2O
Molecular Weight298.35 g/mol
Exact Mass298.11
IUPAC Name5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole
SMILESc1ccc(-c2cnc(-c3ccccc3-c3ccccn3)o2)cc1
InChIInChI=1S/C20H14N2O/c1-2-8-15(9-3-1)19-14-22-20(23-19)17-11-5-4-10-16(17)18-12-6-7-13-21-18/h1-14H
InChIKeyMMGKLIQEORFXQG-UHFFFAOYSA-N
XLogP5.07
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.35
LogP ≤ 55.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole?
The IUPAC name of 5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole (CID 135057630) is 5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole.
What is the SMILES notation for 5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole?
The canonical SMILES for 5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole is c1ccc(-c2cnc(-c3ccccc3-c3ccccn3)o2)cc1.
What is the InChIKey of 5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole?
The InChIKey is MMGKLIQEORFXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N2O/c1-2-8-15(9-3-1)19-14-22-20(23-19)17-11-5-4-10-16(17)18-12-6-7-13-21-18/h1-14H.
What are the key properties of 5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole?
5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole has a molecular weight of 298.35 g/mol, XLogP of 5.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole is sourced from PubChem (CID 135057630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).