3-methyl-5-(2-phenylphenyl)-1,2-oxazole

C16H13NO — CID 123870011

IUPAC3-methyl-5-(2-phenylphenyl)-1,2-oxazole
SMILESCc1cc(-c2ccccc2-c2ccccc2)on1
InChIInChI=1S/C16H13NO/c1-12-11-16(18-17-12)15-10-6-5-9-14(15)13-7-3-2-4-8-13/h2-11H,1H3
InChIKeyOJTPZQUNMQPXTJ-UHFFFAOYSA-N
MW235.29 g/mol
LogP4.32
Rot. Bonds2

About 3-methyl-5-(2-phenylphenyl)-1,2-oxazole

3-methyl-5-(2-phenylphenyl)-1,2-oxazole (PubChem CID 123870011) has the molecular formula C16H13NO and a molecular weight of 235.29 g/mol. Its IUPAC name is 3-methyl-5-(2-phenylphenyl)-1,2-oxazole.

Molecular Properties

Compound Name3-methyl-5-(2-phenylphenyl)-1,2-oxazole
PubChem CID123870011
Molecular FormulaC16H13NO
Molecular Weight235.29 g/mol
Exact Mass235.10
IUPAC Name3-methyl-5-(2-phenylphenyl)-1,2-oxazole
SMILESCc1cc(-c2ccccc2-c2ccccc2)on1
InChIInChI=1S/C16H13NO/c1-12-11-16(18-17-12)15-10-6-5-9-14(15)13-7-3-2-4-8-13/h2-11H,1H3
InChIKeyOJTPZQUNMQPXTJ-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 3-methyl-5-(2-phenylphenyl)-1,2-oxazole?
The IUPAC name of 3-methyl-5-(2-phenylphenyl)-1,2-oxazole (CID 123870011) is 3-methyl-5-(2-phenylphenyl)-1,2-oxazole.
What is the SMILES notation for 3-methyl-5-(2-phenylphenyl)-1,2-oxazole?
The canonical SMILES for 3-methyl-5-(2-phenylphenyl)-1,2-oxazole is Cc1cc(-c2ccccc2-c2ccccc2)on1.
What is the InChIKey of 3-methyl-5-(2-phenylphenyl)-1,2-oxazole?
The InChIKey is OJTPZQUNMQPXTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO/c1-12-11-16(18-17-12)15-10-6-5-9-14(15)13-7-3-2-4-8-13/h2-11H,1H3.
What are the key properties of 3-methyl-5-(2-phenylphenyl)-1,2-oxazole?
3-methyl-5-(2-phenylphenyl)-1,2-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 3-methyl-5-(2-phenylphenyl)-1,2-oxazole is sourced from PubChem (CID 123870011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).