2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one

C7H13NO2 — CID 12380219

IUPAC2-ethyl-5,5-dimethyl-1,2-oxazolidin-3-one
SMILESCCN1C(=O)CC(O1)(C)C
InChIInChI=1S/C7H13NO2/c1-4-8-6(9)5-7(2,3)10-8/h4-5H2,1-3H3
InChIKeyNSZWHYNHNSGDMN-UHFFFAOYSA-N
MW143.18 g/mol
LogP0.50
Rot. Bonds1

About 2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one

2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one (PubChem CID 12380219) has the molecular formula C7H13NO2 and a molecular weight of 143.18 g/mol. Its IUPAC name is 2-ethyl-5,5-dimethyl-1,2-oxazolidin-3-one.

Molecular Properties

Compound Name2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one
PubChem CID12380219
Molecular FormulaC7H13NO2
Molecular Weight143.18 g/mol
Exact Mass143.09
IUPAC Name2-ethyl-5,5-dimethyl-1,2-oxazolidin-3-one
SMILESCCN1C(=O)CC(O1)(C)C
InChIInChI=1S/C7H13NO2/c1-4-8-6(9)5-7(2,3)10-8/h4-5H2,1-3H3
InChIKeyNSZWHYNHNSGDMN-UHFFFAOYSA-N
XLogP0.50
TPSA29.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity154

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.18
LogP ≤ 50.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5,5-Trimethyl-1,2-oxazolidin-3-one
CID 12326450
2-But-3-ynyl-5,5-dimethyl-1,2-oxazolidin-3-one
CID 59730718
1-[(2-Methylpropan-2-yl)oxy]pyrrolidin-2-one
CID 89730131
2,4-Diethyl-1,2-oxazolidin-3-one
CID 148366661
Ethane;2-ethyl-5,5-dimethyl-1,2-oxazolidin-3-one
CID 177197066
5,5-Dimethyl-2-(2-methylpropyl)-1,2-oxazolidin-3-one
CID 177197067
5,5-Dimethyl-2-propyl-1,2-oxazolidin-3-one
CID 177197073
2-Butyl-5,5-dimethyl-1,2-oxazolidin-3-one
CID 12380214
5,5-Dimethyl-2-propan-2-yl-1,2-oxazolidin-3-one
CID 12380216
2-Butan-2-yl-5,5-dimethyl-1,2-oxazolidin-3-one
CID 12380217
3-Methoxy-3-methyl-1-(1,2-oxazolidin-2-yl)butan-1-one
CID 103021021
2-(5,5-Dimethyl-3-oxo-1,2-oxazolidin-2-yl)acetaldehyde
CID 105430620

Frequently Asked Questions

What is the IUPAC name of 2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one?
The IUPAC name of 2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one (CID 12380219) is 2-ethyl-5,5-dimethyl-1,2-oxazolidin-3-one.
What is the SMILES notation for 2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one?
The canonical SMILES for 2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one is CCN1C(=O)CC(O1)(C)C.
What is the InChIKey of 2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one?
The InChIKey is NSZWHYNHNSGDMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-4-8-6(9)5-7(2,3)10-8/h4-5H2,1-3H3.
What are the key properties of 2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one?
2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one has a molecular weight of 143.18 g/mol, XLogP of 0.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Ethyl-5,5-dimethyl-1,2-oxazolidin-3-one is sourced from PubChem (CID 12380219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).