3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one

C9H17NO3 — CID 23248339

IUPAC3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one
SMILESCCOC(C)N1C(=O)OCC1CC
InChIInChI=1S/C9H17NO3/c1-4-8-6-13-9(11)10(8)7(3)12-5-2/h7-8H,4-6H2,1-3H3
InChIKeyWMYLWXISKMFEQZ-UHFFFAOYSA-N
MW187.24 g/mol
LogP1.60
Rot. Bonds4

About 3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one

3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one (PubChem CID 23248339) has the molecular formula C9H17NO3 and a molecular weight of 187.24 g/mol. Its IUPAC name is 3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one
PubChem CID23248339
Molecular FormulaC9H17NO3
Molecular Weight187.24 g/mol
Exact Mass187.12
IUPAC Name3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one
SMILESCCOC(C)N1C(=O)OCC1CC
InChIInChI=1S/C9H17NO3/c1-4-8-6-13-9(11)10(8)7(3)12-5-2/h7-8H,4-6H2,1-3H3
InChIKeyWMYLWXISKMFEQZ-UHFFFAOYSA-N
XLogP1.60
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one?
The IUPAC name of 3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one (CID 23248339) is 3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one is CCOC(C)N1C(=O)OCC1CC.
What is the InChIKey of 3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one?
The InChIKey is WMYLWXISKMFEQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO3/c1-4-8-6-13-9(11)10(8)7(3)12-5-2/h7-8H,4-6H2,1-3H3.
What are the key properties of 3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one?
3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one has a molecular weight of 187.24 g/mol, XLogP of 1.60, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethoxyethyl)-4-ethyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 23248339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).