2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide

C13H18N2O3S — CID 44612074

IUPAC2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide
SMILESCCN1CCOC(=O)C1CC(=O)NCc1cccs1
InChIInChI=1S/C13H18N2O3S/c1-2-15-5-6-18-13(17)11(15)8-12(16)14-9-10-4-3-7-19-10/h3-4,7,11H,2,5-6,8-9H2,1H3,(H,14,16)
InChIKeySGVAQCOKEHMNGX-UHFFFAOYSA-N
MW282.36 g/mol
LogP1.00
Rot. Bonds5

About 2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide

2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 44612074) has the molecular formula C13H18N2O3S and a molecular weight of 282.36 g/mol. Its IUPAC name is 2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide
PubChem CID44612074
Molecular FormulaC13H18N2O3S
Molecular Weight282.36 g/mol
Exact Mass282.10
IUPAC Name2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide
SMILESCCN1CCOC(=O)C1CC(=O)NCc1cccs1
InChIInChI=1S/C13H18N2O3S/c1-2-15-5-6-18-13(17)11(15)8-12(16)14-9-10-4-3-7-19-10/h3-4,7,11H,2,5-6,8-9H2,1H3,(H,14,16)
InChIKeySGVAQCOKEHMNGX-UHFFFAOYSA-N
XLogP1.00
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.36
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of 2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide (CID 44612074) is 2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for 2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide is CCN1CCOC(=O)C1CC(=O)NCc1cccs1.
What is the InChIKey of 2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is SGVAQCOKEHMNGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3S/c1-2-15-5-6-18-13(17)11(15)8-12(16)14-9-10-4-3-7-19-10/h3-4,7,11H,2,5-6,8-9H2,1H3,(H,14,16).
What are the key properties of 2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 282.36 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-2-oxomorpholin-3-yl)-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 44612074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).