4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine

C11H15F3N2O2 — CID 83959756

IUPAC4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine
SMILESCCc1c(C(F)(F)F)noc1CN1CCOCC1
InChIInChI=1S/C11H15F3N2O2/c1-2-8-9(7-16-3-5-17-6-4-16)18-15-10(8)11(12,13)14/h2-7H2,1H3
InChIKeyNOVHQIUDYMZVMN-UHFFFAOYSA-N
MW264.25 g/mol
LogP2.09
Rot. Bonds3

About 4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine

4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine (PubChem CID 83959756) has the molecular formula C11H15F3N2O2 and a molecular weight of 264.25 g/mol. Its IUPAC name is 4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine
PubChem CID83959756
Molecular FormulaC11H15F3N2O2
Molecular Weight264.25 g/mol
Exact Mass264.11
IUPAC Name4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine
SMILESCCc1c(C(F)(F)F)noc1CN1CCOCC1
InChIInChI=1S/C11H15F3N2O2/c1-2-8-9(7-16-3-5-17-6-4-16)18-15-10(8)11(12,13)14/h2-7H2,1H3
InChIKeyNOVHQIUDYMZVMN-UHFFFAOYSA-N
XLogP2.09
TPSA38.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.25
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine?
The IUPAC name of 4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine (CID 83959756) is 4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine.
What is the SMILES notation for 4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine?
The canonical SMILES for 4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine is CCc1c(C(F)(F)F)noc1CN1CCOCC1.
What is the InChIKey of 4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine?
The InChIKey is NOVHQIUDYMZVMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2O2/c1-2-8-9(7-16-3-5-17-6-4-16)18-15-10(8)11(12,13)14/h2-7H2,1H3.
What are the key properties of 4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine?
4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine has a molecular weight of 264.25 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 4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine is sourced from PubChem (CID 83959756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).