4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole

C15H19NO — CID 142936111

IUPAC4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole
SMILESCCc1nc(-c2ccc(C(C)C)cc2)oc1C
InChIInChI=1S/C15H19NO/c1-5-14-11(4)17-15(16-14)13-8-6-12(7-9-13)10(2)3/h6-10H,5H2,1-4H3
InChIKeyURURMUFIGRHUTL-UHFFFAOYSA-N
MW229.32 g/mol
LogP4.34
Rot. Bonds3

About 4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole

4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole (PubChem CID 142936111) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole.

Molecular Properties

Compound Name4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole
PubChem CID142936111
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole
SMILESCCc1nc(-c2ccc(C(C)C)cc2)oc1C
InChIInChI=1S/C15H19NO/c1-5-14-11(4)17-15(16-14)13-8-6-12(7-9-13)10(2)3/h6-10H,5H2,1-4H3
InChIKeyURURMUFIGRHUTL-UHFFFAOYSA-N
XLogP4.34
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole?
The IUPAC name of 4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole (CID 142936111) is 4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole.
What is the SMILES notation for 4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole?
The canonical SMILES for 4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole is CCc1nc(-c2ccc(C(C)C)cc2)oc1C.
What is the InChIKey of 4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole?
The InChIKey is URURMUFIGRHUTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-5-14-11(4)17-15(16-14)13-8-6-12(7-9-13)10(2)3/h6-10H,5H2,1-4H3.
What are the key properties of 4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole?
4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole has a molecular weight of 229.32 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazole is sourced from PubChem (CID 142936111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).