4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine

C9H16N2O2 — CID 21392985

IUPAC4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine
SMILESCCC1COC(N2CCOCC2)=N1
InChIInChI=1S/C9H16N2O2/c1-2-8-7-13-9(10-8)11-3-5-12-6-4-11/h8H,2-7H2,1H3
InChIKeyJFDVFGXCSIMVNT-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.48
Rot. Bonds1

About 4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine

4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine (PubChem CID 21392985) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine.

Molecular Properties

Compound Name4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine
PubChem CID21392985
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine
SMILESCCC1COC(N2CCOCC2)=N1
InChIInChI=1S/C9H16N2O2/c1-2-8-7-13-9(10-8)11-3-5-12-6-4-11/h8H,2-7H2,1H3
InChIKeyJFDVFGXCSIMVNT-UHFFFAOYSA-N
XLogP0.48
TPSA34.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine?
The IUPAC name of 4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine (CID 21392985) is 4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine.
What is the SMILES notation for 4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine?
The canonical SMILES for 4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine is CCC1COC(N2CCOCC2)=N1.
What is the InChIKey of 4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine?
The InChIKey is JFDVFGXCSIMVNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-2-8-7-13-9(10-8)11-3-5-12-6-4-11/h8H,2-7H2,1H3.
What are the key properties of 4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine?
4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine has a molecular weight of 184.24 g/mol, XLogP of 0.48, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)morpholine is sourced from PubChem (CID 21392985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).