(4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide

C6H10N2O3S — CID 142625682

IUPAC(4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide
SMILESNC(=O)[C@@H]1CSC(=O)N1CCO
InChIInChI=1S/C6H10N2O3S/c7-5(10)4-3-12-6(11)8(4)1-2-9/h4,9H,1-3H2,(H2,7,10)/t4-/m0/s1
InChIKeyZFOWFACDPWQMQE-BYPYZUCNSA-N
MW190.22 g/mol
LogP-1.00
Rot. Bonds3

About (4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide

(4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide (PubChem CID 142625682) has the molecular formula C6H10N2O3S and a molecular weight of 190.22 g/mol. Its IUPAC name is (4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name(4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide
PubChem CID142625682
Molecular FormulaC6H10N2O3S
Molecular Weight190.22 g/mol
Exact Mass190.04
IUPAC Name(4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide
SMILESNC(=O)[C@@H]1CSC(=O)N1CCO
InChIInChI=1S/C6H10N2O3S/c7-5(10)4-3-12-6(11)8(4)1-2-9/h4,9H,1-3H2,(H2,7,10)/t4-/m0/s1
InChIKeyZFOWFACDPWQMQE-BYPYZUCNSA-N
XLogP-1.00
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.22
LogP ≤ 5-1.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide?
The IUPAC name of (4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide (CID 142625682) is (4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for (4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for (4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide is NC(=O)[C@@H]1CSC(=O)N1CCO.
What is the InChIKey of (4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide?
The InChIKey is ZFOWFACDPWQMQE-BYPYZUCNSA-N. The full InChI is InChI=1S/C6H10N2O3S/c7-5(10)4-3-12-6(11)8(4)1-2-9/h4,9H,1-3H2,(H2,7,10)/t4-/m0/s1.
What are the key properties of (4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide?
(4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide has a molecular weight of 190.22 g/mol, XLogP of -1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3-(2-hydroxyethyl)-2-oxo-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 142625682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).