2-methyl-4-(4-phenylphenyl)-1,3-oxazole

C16H13NO — CID 162644777

IUPAC2-methyl-4-(4-phenylphenyl)-1,3-oxazole
SMILESCc1nc(-c2ccc(-c3ccccc3)cc2)co1
InChIInChI=1S/C16H13NO/c1-12-17-16(11-18-12)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-11H,1H3
InChIKeyRUHFQXDMZZFPLN-UHFFFAOYSA-N
MW235.29 g/mol
LogP4.32
Rot. Bonds2

About 2-methyl-4-(4-phenylphenyl)-1,3-oxazole

2-methyl-4-(4-phenylphenyl)-1,3-oxazole (PubChem CID 162644777) has the molecular formula C16H13NO and a molecular weight of 235.29 g/mol. Its IUPAC name is 2-methyl-4-(4-phenylphenyl)-1,3-oxazole.

Molecular Properties

Compound Name2-methyl-4-(4-phenylphenyl)-1,3-oxazole
PubChem CID162644777
Molecular FormulaC16H13NO
Molecular Weight235.29 g/mol
Exact Mass235.10
IUPAC Name2-methyl-4-(4-phenylphenyl)-1,3-oxazole
SMILESCc1nc(-c2ccc(-c3ccccc3)cc2)co1
InChIInChI=1S/C16H13NO/c1-12-17-16(11-18-12)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-11H,1H3
InChIKeyRUHFQXDMZZFPLN-UHFFFAOYSA-N
XLogP4.32
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(4-phenylphenyl)-1,3-oxazole?
The IUPAC name of 2-methyl-4-(4-phenylphenyl)-1,3-oxazole (CID 162644777) is 2-methyl-4-(4-phenylphenyl)-1,3-oxazole.
What is the SMILES notation for 2-methyl-4-(4-phenylphenyl)-1,3-oxazole?
The canonical SMILES for 2-methyl-4-(4-phenylphenyl)-1,3-oxazole is Cc1nc(-c2ccc(-c3ccccc3)cc2)co1.
What is the InChIKey of 2-methyl-4-(4-phenylphenyl)-1,3-oxazole?
The InChIKey is RUHFQXDMZZFPLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO/c1-12-17-16(11-18-12)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-11H,1H3.
What are the key properties of 2-methyl-4-(4-phenylphenyl)-1,3-oxazole?
2-methyl-4-(4-phenylphenyl)-1,3-oxazole has a molecular weight of 235.29 g/mol, XLogP of 4.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(4-phenylphenyl)-1,3-oxazole is sourced from PubChem (CID 162644777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).