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

C7H11N3O4S — CID 112551088

IUPACN-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESNC(=O)CONC(=O)CN1CSCC1=O
InChIInChI=1S/C7H11N3O4S/c8-5(11)2-14-9-6(12)1-10-4-15-3-7(10)13/h1-4H2,(H2,8,11)(H,9,12)
InChIKeyWYQNLOOTUYRUAP-UHFFFAOYSA-N
MW233.25 g/mol
LogP-1.95
Rot. Bonds5

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

N-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 112551088) has the molecular formula C7H11N3O4S and a molecular weight of 233.25 g/mol. Its IUPAC name is N-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID112551088
Molecular FormulaC7H11N3O4S
Molecular Weight233.25 g/mol
Exact Mass233.05
IUPAC NameN-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESNC(=O)CONC(=O)CN1CSCC1=O
InChIInChI=1S/C7H11N3O4S/c8-5(11)2-14-9-6(12)1-10-4-15-3-7(10)13/h1-4H2,(H2,8,11)(H,9,12)
InChIKeyWYQNLOOTUYRUAP-UHFFFAOYSA-N
XLogP-1.95
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.25
LogP ≤ 5-1.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 112551088) is N-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is NC(=O)CONC(=O)CN1CSCC1=O.
What is the InChIKey of N-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is WYQNLOOTUYRUAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O4S/c8-5(11)2-14-9-6(12)1-10-4-15-3-7(10)13/h1-4H2,(H2,8,11)(H,9,12).
What are the key properties of N-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 233.25 g/mol, XLogP of -1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethoxy)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 112551088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).