(4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione

C5H7NO3 — CID 59001744

IUPAC(4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione
SMILESC[C@@H]1C(=O)OC(=O)N1C
InChIInChI=1S/C5H7NO3/c1-3-4(7)9-5(8)6(3)2/h3H,1-2H3/t3-/m1/s1
InChIKeyWTFJJYYGWFKOQH-GSVOUGTGSA-N
MW129.11 g/mol
LogP-0.02
Rot. Bonds

About (4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione

(4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione (PubChem CID 59001744) has the molecular formula C5H7NO3 and a molecular weight of 129.11 g/mol. Its IUPAC name is (4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione.

Molecular Properties

Compound Name(4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione
PubChem CID59001744
Molecular FormulaC5H7NO3
Molecular Weight129.11 g/mol
Exact Mass129.04
IUPAC Name(4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione
SMILESC[C@@H]1C(=O)OC(=O)N1C
InChIInChI=1S/C5H7NO3/c1-3-4(7)9-5(8)6(3)2/h3H,1-2H3/t3-/m1/s1
InChIKeyWTFJJYYGWFKOQH-GSVOUGTGSA-N
XLogP-0.02
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.11
LogP ≤ 5-0.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione?
The IUPAC name of (4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione (CID 59001744) is (4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione.
What is the SMILES notation for (4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione?
The canonical SMILES for (4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione is C[C@@H]1C(=O)OC(=O)N1C.
What is the InChIKey of (4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione?
The InChIKey is WTFJJYYGWFKOQH-GSVOUGTGSA-N. The full InChI is InChI=1S/C5H7NO3/c1-3-4(7)9-5(8)6(3)2/h3H,1-2H3/t3-/m1/s1.
What are the key properties of (4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione?
(4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione has a molecular weight of 129.11 g/mol, XLogP of -0.02, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3,4-dimethyl-1,3-oxazolidine-2,5-dione is sourced from PubChem (CID 59001744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).