5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole

C23H19NO — CID 140714662

IUPAC5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole
SMILESCc1cc(-c2ccccc2)cc(C)c1-c1cnc(-c2ccccc2)o1
InChIInChI=1S/C23H19NO/c1-16-13-20(18-9-5-3-6-10-18)14-17(2)22(16)21-15-24-23(25-21)19-11-7-4-8-12-19/h3-15H,1-2H3
InChIKeyJVWFBIBVBOEHJK-UHFFFAOYSA-N
MW325.41 g/mol
LogP6.29
Rot. Bonds3

About 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole

5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole (PubChem CID 140714662) has the molecular formula C23H19NO and a molecular weight of 325.41 g/mol. Its IUPAC name is 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole.

Molecular Properties

Compound Name5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole
PubChem CID140714662
Molecular FormulaC23H19NO
Molecular Weight325.41 g/mol
Exact Mass325.15
IUPAC Name5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole
SMILESCc1cc(-c2ccccc2)cc(C)c1-c1cnc(-c2ccccc2)o1
InChIInChI=1S/C23H19NO/c1-16-13-20(18-9-5-3-6-10-18)14-17(2)22(16)21-15-24-23(25-21)19-11-7-4-8-12-19/h3-15H,1-2H3
InChIKeyJVWFBIBVBOEHJK-UHFFFAOYSA-N
XLogP6.29
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.41
LogP ≤ 56.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-(4-methylphenyl)-2-phenyl-1,3-oxazole
CID 3946772
5-(4-tert-butyl-2,6-dimethylphenyl)-2-pyridin-4-yl-1,3-oxazole
CID 10380451
5-(5-methylthiophen-2-yl)-2-phenyl-1,3-oxazole
CID 14424350
5-(4-bromophenyl)-2-(4-phenylphenyl)-1,3-oxazole
CID 71327927
2-(4-phenylphenyl)-5-(4-propan-2-ylphenyl)-1,3-oxazole
CID 71327926
2-(4-iodophenyl)-5-phenyl-1,3-oxazole
CID 19894925
2-(2-phenyl-1,3-oxazol-5-yl)phenol
CID 11128316
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-phenyl-1,3-oxazole
CID 102314200
5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-thiazole
CID 140714930
5-phenyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazole
CID 102265146
5-[(2-methylphenyl)methyl]-2-phenyl-1,3-oxazole
CID 11414009
2-phenyl-1,3-oxazole-5-carbonitrile
CID 130055318

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole?
The IUPAC name of 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole (CID 140714662) is 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole.
What is the SMILES notation for 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole?
The canonical SMILES for 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole is Cc1cc(-c2ccccc2)cc(C)c1-c1cnc(-c2ccccc2)o1.
What is the InChIKey of 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole?
The InChIKey is JVWFBIBVBOEHJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO/c1-16-13-20(18-9-5-3-6-10-18)14-17(2)22(16)21-15-24-23(25-21)19-11-7-4-8-12-19/h3-15H,1-2H3.
What are the key properties of 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole?
5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole has a molecular weight of 325.41 g/mol, XLogP of 6.29, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-dimethyl-4-phenylphenyl)-2-phenyl-1,3-oxazole is sourced from PubChem (CID 140714662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).