(3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide

C10H12N2O3S — CID 97425366

IUPAC(3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide
SMILESCC1(C)OC(=O)C[C@H]1C(=O)Nc1nccs1
InChIInChI=1S/C10H12N2O3S/c1-10(2)6(5-7(13)15-10)8(14)12-9-11-3-4-16-9/h3-4,6H,5H2,1-2H3,(H,11,12,14)/t6-/m0/s1
InChIKeyMLYYKFQNVOOXCD-LURJTMIESA-N
MW240.28 g/mol
LogP1.42
Rot. Bonds2

About (3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide

(3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide (PubChem CID 97425366) has the molecular formula C10H12N2O3S and a molecular weight of 240.28 g/mol. Its IUPAC name is (3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name(3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide
PubChem CID97425366
Molecular FormulaC10H12N2O3S
Molecular Weight240.28 g/mol
Exact Mass240.06
IUPAC Name(3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide
SMILESCC1(C)OC(=O)C[C@H]1C(=O)Nc1nccs1
InChIInChI=1S/C10H12N2O3S/c1-10(2)6(5-7(13)15-10)8(14)12-9-11-3-4-16-9/h3-4,6H,5H2,1-2H3,(H,11,12,14)/t6-/m0/s1
InChIKeyMLYYKFQNVOOXCD-LURJTMIESA-N
XLogP1.42
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.28
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide?
The IUPAC name of (3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide (CID 97425366) is (3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide.
What is the SMILES notation for (3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide?
The canonical SMILES for (3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide is CC1(C)OC(=O)C[C@H]1C(=O)Nc1nccs1.
What is the InChIKey of (3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide?
The InChIKey is MLYYKFQNVOOXCD-LURJTMIESA-N. The full InChI is InChI=1S/C10H12N2O3S/c1-10(2)6(5-7(13)15-10)8(14)12-9-11-3-4-16-9/h3-4,6H,5H2,1-2H3,(H,11,12,14)/t6-/m0/s1.
What are the key properties of (3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide?
(3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide has a molecular weight of 240.28 g/mol, XLogP of 1.42, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-2,2-dimethyl-5-oxo-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide is sourced from PubChem (CID 97425366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).