5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one

C8H15NO3 — CID 105435469

IUPAC5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one
SMILESCCC1(C)CC(=O)N(CCO)O1
InChIInChI=1S/C8H15NO3/c1-3-8(2)6-7(11)9(12-8)4-5-10/h10H,3-6H2,1-2H3
InChIKeyNQSILVSLVOLNIK-UHFFFAOYSA-N
MW173.21 g/mol
LogP0.31
Rot. Bonds3

About 5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one

5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one (PubChem CID 105435469) has the molecular formula C8H15NO3 and a molecular weight of 173.21 g/mol. Its IUPAC name is 5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one.

Molecular Properties

Compound Name5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one
PubChem CID105435469
Molecular FormulaC8H15NO3
Molecular Weight173.21 g/mol
Exact Mass173.11
IUPAC Name5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one
SMILESCCC1(C)CC(=O)N(CCO)O1
InChIInChI=1S/C8H15NO3/c1-3-8(2)6-7(11)9(12-8)4-5-10/h10H,3-6H2,1-2H3
InChIKeyNQSILVSLVOLNIK-UHFFFAOYSA-N
XLogP0.31
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one?
The IUPAC name of 5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one (CID 105435469) is 5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one.
What is the SMILES notation for 5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one?
The canonical SMILES for 5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one is CCC1(C)CC(=O)N(CCO)O1.
What is the InChIKey of 5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one?
The InChIKey is NQSILVSLVOLNIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3/c1-3-8(2)6-7(11)9(12-8)4-5-10/h10H,3-6H2,1-2H3.
What are the key properties of 5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one?
5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one has a molecular weight of 173.21 g/mol, XLogP of 0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(2-hydroxyethyl)-5-methyl-1,2-oxazolidin-3-one is sourced from PubChem (CID 105435469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).