(4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide

C7H15NO3S — CID 175841872

IUPAC(4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide
SMILESC[C@@H]1COS(=O)(=O)N1C(C)(C)C
InChIInChI=1S/C7H15NO3S/c1-6-5-11-12(9,10)8(6)7(2,3)4/h6H,5H2,1-4H3/t6-/m1/s1
InChIKeyQDILDQUVPGLMNI-ZCFIWIBFSA-N
MW193.27 g/mol
LogP0.75
Rot. Bonds

About (4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide

(4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide (PubChem CID 175841872) has the molecular formula C7H15NO3S and a molecular weight of 193.27 g/mol. Its IUPAC name is (4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide.

Molecular Properties

Compound Name(4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide
PubChem CID175841872
Molecular FormulaC7H15NO3S
Molecular Weight193.27 g/mol
Exact Mass193.08
IUPAC Name(4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide
SMILESC[C@@H]1COS(=O)(=O)N1C(C)(C)C
InChIInChI=1S/C7H15NO3S/c1-6-5-11-12(9,10)8(6)7(2,3)4/h6H,5H2,1-4H3/t6-/m1/s1
InChIKeyQDILDQUVPGLMNI-ZCFIWIBFSA-N
XLogP0.75
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide?
The IUPAC name of (4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide (CID 175841872) is (4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide.
What is the SMILES notation for (4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide?
The canonical SMILES for (4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide is C[C@@H]1COS(=O)(=O)N1C(C)(C)C.
What is the InChIKey of (4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide?
The InChIKey is QDILDQUVPGLMNI-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H15NO3S/c1-6-5-11-12(9,10)8(6)7(2,3)4/h6H,5H2,1-4H3/t6-/m1/s1.
What are the key properties of (4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide?
(4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide has a molecular weight of 193.27 g/mol, XLogP of 0.75, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3-tert-butyl-4-methyloxathiazolidine 2,2-dioxide is sourced from PubChem (CID 175841872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).