N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide

C7H12N2O3S — CID 52555844

IUPACN-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCCONC(=O)CN1CSCC1=O
InChIInChI=1S/C7H12N2O3S/c1-2-12-8-6(10)3-9-5-13-4-7(9)11/h2-5H2,1H3,(H,8,10)
InChIKeySNJYFMGNHQQQNR-UHFFFAOYSA-N
MW204.25 g/mol
LogP-0.41
Rot. Bonds4

About N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide

N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 52555844) has the molecular formula C7H12N2O3S and a molecular weight of 204.25 g/mol. Its IUPAC name is N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID52555844
Molecular FormulaC7H12N2O3S
Molecular Weight204.25 g/mol
Exact Mass204.06
IUPAC NameN-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCCONC(=O)CN1CSCC1=O
InChIInChI=1S/C7H12N2O3S/c1-2-12-8-6(10)3-9-5-13-4-7(9)11/h2-5H2,1H3,(H,8,10)
InChIKeySNJYFMGNHQQQNR-UHFFFAOYSA-N
XLogP-0.41
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.25
LogP ≤ 5-0.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 52555844) is N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is CCONC(=O)CN1CSCC1=O.
What is the InChIKey of N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is SNJYFMGNHQQQNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O3S/c1-2-12-8-6(10)3-9-5-13-4-7(9)11/h2-5H2,1H3,(H,8,10).
What are the key properties of N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 204.25 g/mol, XLogP of -0.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethoxy-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 52555844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).