cyclohexyl 2-(1,2-oxazol-5-yl)acetate

C11H15NO3 — CID 159710409

IUPACcyclohexyl 2-(1,2-oxazol-5-yl)acetate
SMILESO=C(Cc1ccno1)OC1CCCCC1
InChIInChI=1S/C11H15NO3/c13-11(8-10-6-7-12-15-10)14-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2
InChIKeyMYTLIQRUGKLJSZ-UHFFFAOYSA-N
MW209.24 g/mol
LogP2.09
Rot. Bonds3

About cyclohexyl 2-(1,2-oxazol-5-yl)acetate

cyclohexyl 2-(1,2-oxazol-5-yl)acetate (PubChem CID 159710409) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is cyclohexyl 2-(1,2-oxazol-5-yl)acetate.

Molecular Properties

Compound Namecyclohexyl 2-(1,2-oxazol-5-yl)acetate
PubChem CID159710409
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Namecyclohexyl 2-(1,2-oxazol-5-yl)acetate
SMILESO=C(Cc1ccno1)OC1CCCCC1
InChIInChI=1S/C11H15NO3/c13-11(8-10-6-7-12-15-10)14-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2
InChIKeyMYTLIQRUGKLJSZ-UHFFFAOYSA-N
XLogP2.09
TPSA52.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl 2-(1,2-oxazol-5-yl)acetate?
The IUPAC name of cyclohexyl 2-(1,2-oxazol-5-yl)acetate (CID 159710409) is cyclohexyl 2-(1,2-oxazol-5-yl)acetate.
What is the SMILES notation for cyclohexyl 2-(1,2-oxazol-5-yl)acetate?
The canonical SMILES for cyclohexyl 2-(1,2-oxazol-5-yl)acetate is O=C(Cc1ccno1)OC1CCCCC1.
What is the InChIKey of cyclohexyl 2-(1,2-oxazol-5-yl)acetate?
The InChIKey is MYTLIQRUGKLJSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c13-11(8-10-6-7-12-15-10)14-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2.
What are the key properties of cyclohexyl 2-(1,2-oxazol-5-yl)acetate?
cyclohexyl 2-(1,2-oxazol-5-yl)acetate has a molecular weight of 209.24 g/mol, XLogP of 2.09, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl 2-(1,2-oxazol-5-yl)acetate is sourced from PubChem (CID 159710409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).