(3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide

C4H10N2OS — CID 89345517

IUPAC(3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide
SMILESCC[C@@H]1CNS(=O)N1
InChIInChI=1S/C4H10N2OS/c1-2-4-3-5-8(7)6-4/h4-6H,2-3H2,1H3/t4-,8?/m1/s1
InChIKeyNKIQCVCLADKKLH-WZIMWHJTSA-N
MW134.20 g/mol
LogP-0.46
Rot. Bonds1

About (3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide

(3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide (PubChem CID 89345517) has the molecular formula C4H10N2OS and a molecular weight of 134.20 g/mol. Its IUPAC name is (3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide.

Molecular Properties

Compound Name(3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide
PubChem CID89345517
Molecular FormulaC4H10N2OS
Molecular Weight134.20 g/mol
Exact Mass134.05
IUPAC Name(3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide
SMILESCC[C@@H]1CNS(=O)N1
InChIInChI=1S/C4H10N2OS/c1-2-4-3-5-8(7)6-4/h4-6H,2-3H2,1H3/t4-,8?/m1/s1
InChIKeyNKIQCVCLADKKLH-WZIMWHJTSA-N
XLogP-0.46
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.20
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze (3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide 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 (3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide?
The IUPAC name of (3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide (CID 89345517) is (3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide.
What is the SMILES notation for (3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide?
The canonical SMILES for (3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide is CC[C@@H]1CNS(=O)N1.
What is the InChIKey of (3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide?
The InChIKey is NKIQCVCLADKKLH-WZIMWHJTSA-N. The full InChI is InChI=1S/C4H10N2OS/c1-2-4-3-5-8(7)6-4/h4-6H,2-3H2,1H3/t4-,8?/m1/s1.
What are the key properties of (3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide?
(3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide has a molecular weight of 134.20 g/mol, XLogP of -0.46, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-ethyl-1,2,5-thiadiazolidine 1-oxide is sourced from PubChem (CID 89345517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).