N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide

C7H10N2O4S — CID 16769173

IUPACN-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide
SMILESO=C(CO)NCCN1C(=O)CSC1=O
InChIInChI=1S/C7H10N2O4S/c10-3-5(11)8-1-2-9-6(12)4-14-7(9)13/h10H,1-4H2,(H,8,11)
InChIKeyPOANJAMIHCLVLT-UHFFFAOYSA-N
MW218.23 g/mol
LogP-1.21
Rot. Bonds4

About N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide

N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide (PubChem CID 16769173) has the molecular formula C7H10N2O4S and a molecular weight of 218.23 g/mol. Its IUPAC name is N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide.

Molecular Properties

Compound NameN-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide
PubChem CID16769173
Molecular FormulaC7H10N2O4S
Molecular Weight218.23 g/mol
Exact Mass218.04
IUPAC NameN-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide
SMILESO=C(CO)NCCN1C(=O)CSC1=O
InChIInChI=1S/C7H10N2O4S/c10-3-5(11)8-1-2-9-6(12)4-14-7(9)13/h10H,1-4H2,(H,8,11)
InChIKeyPOANJAMIHCLVLT-UHFFFAOYSA-N
XLogP-1.21
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.23
LogP ≤ 5-1.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thioester', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide?
The IUPAC name of N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide (CID 16769173) is N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide.
What is the SMILES notation for N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide?
The canonical SMILES for N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide is O=C(CO)NCCN1C(=O)CSC1=O.
What is the InChIKey of N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide?
The InChIKey is POANJAMIHCLVLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O4S/c10-3-5(11)8-1-2-9-6(12)4-14-7(9)13/h10H,1-4H2,(H,8,11).
What are the key properties of N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide?
N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide has a molecular weight of 218.23 g/mol, XLogP of -1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dioxo-1,3-thiazolidin-3-yl)ethyl]-2-hydroxyacetamide is sourced from PubChem (CID 16769173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).