ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate

C10H13NO3 — CID 18983302

IUPACethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate
SMILESCCOC(=O)c1ncoc1C1CCC1
InChIInChI=1S/C10H13NO3/c1-2-13-10(12)8-9(14-6-11-8)7-4-3-5-7/h6-7H,2-5H2,1H3
InChIKeyFXQKPSZRTKOBDN-UHFFFAOYSA-N
MW195.22 g/mol
LogP2.12
Rot. Bonds3

About ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate

ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate (PubChem CID 18983302) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate.

Molecular Properties

Compound Nameethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate
PubChem CID18983302
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Nameethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate
SMILESCCOC(=O)c1ncoc1C1CCC1
InChIInChI=1S/C10H13NO3/c1-2-13-10(12)8-9(14-6-11-8)7-4-3-5-7/h6-7H,2-5H2,1H3
InChIKeyFXQKPSZRTKOBDN-UHFFFAOYSA-N
XLogP2.12
TPSA52.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate?
The IUPAC name of ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate (CID 18983302) is ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate.
What is the SMILES notation for ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate?
The canonical SMILES for ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate is CCOC(=O)c1ncoc1C1CCC1.
What is the InChIKey of ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate?
The InChIKey is FXQKPSZRTKOBDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-2-13-10(12)8-9(14-6-11-8)7-4-3-5-7/h6-7H,2-5H2,1H3.
What are the key properties of ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate?
ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate has a molecular weight of 195.22 g/mol, XLogP of 2.12, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 5-cyclobutyl-1,3-oxazole-4-carboxylate is sourced from PubChem (CID 18983302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).