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

C4H5NO3 — CID 2759968

IUPAC(4R)-4-methyl-1,3-oxazolidine-2,5-dione
SMILESC[C@H]1NC(=O)OC1=O
InChIInChI=1S/C4H5NO3/c1-2-3(6)8-4(7)5-2/h2H,1H3,(H,5,7)/t2-/m1/s1
InChIKeyDTETYCNJKAUROO-UWTATZPHSA-N
MW115.09 g/mol
LogP-0.36
Rot. Bonds

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

(4R)-4-methyl-1,3-oxazolidine-2,5-dione (PubChem CID 2759968) has the molecular formula C4H5NO3 and a molecular weight of 115.09 g/mol. Its IUPAC name is (4R)-4-methyl-1,3-oxazolidine-2,5-dione.

Molecular Properties

Compound Name(4R)-4-methyl-1,3-oxazolidine-2,5-dione
PubChem CID2759968
Molecular FormulaC4H5NO3
Molecular Weight115.09 g/mol
Exact Mass115.03
IUPAC Name(4R)-4-methyl-1,3-oxazolidine-2,5-dione
SMILESC[C@H]1NC(=O)OC1=O
InChIInChI=1S/C4H5NO3/c1-2-3(6)8-4(7)5-2/h2H,1H3,(H,5,7)/t2-/m1/s1
InChIKeyDTETYCNJKAUROO-UWTATZPHSA-N
XLogP-0.36
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.09
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-Isopropyloxazolidine-2,5-dione
CID 102885
4-Methyl-1,3-oxazolidin-2-one
CID 9855455
(s)-Methyl 2-oxooxazolidine-4-carboxylate
CID 385463
(S)-4-Methyloxazolidin-2-one
CID 8063308
2,5-Oxazolidinedione, 4-(1-methylethyl)-, (4S)-
CID 9898854
(S)-4-Methyloxazolidine-2,5-dione
CID 10996998
(L)-3,4-dimethyl-1,3-oxazolidine-2,5-dione
CID 54448435
Ethyl 2-oxo-1,3-oxazolidine-4-carboxylate
CID 538344
(R)-4-Methyloxazolidin-2-one
CID 2734858
(S)-4-(Ethoxycarbonyl)oxazolidine-2-one
CID 12163241
(R)-Methyl 2-oxooxazolidine-4-carboxylate
CID 385465
Methyl 2-oxooxazolidine-4-carboxylate
CID 500251

Frequently Asked Questions

What is the IUPAC name of (4R)-4-methyl-1,3-oxazolidine-2,5-dione?
The IUPAC name of (4R)-4-methyl-1,3-oxazolidine-2,5-dione (CID 2759968) is (4R)-4-methyl-1,3-oxazolidine-2,5-dione.
What is the SMILES notation for (4R)-4-methyl-1,3-oxazolidine-2,5-dione?
The canonical SMILES for (4R)-4-methyl-1,3-oxazolidine-2,5-dione is C[C@H]1NC(=O)OC1=O.
What is the InChIKey of (4R)-4-methyl-1,3-oxazolidine-2,5-dione?
The InChIKey is DTETYCNJKAUROO-UWTATZPHSA-N. The full InChI is InChI=1S/C4H5NO3/c1-2-3(6)8-4(7)5-2/h2H,1H3,(H,5,7)/t2-/m1/s1.
What are the key properties of (4R)-4-methyl-1,3-oxazolidine-2,5-dione?
(4R)-4-methyl-1,3-oxazolidine-2,5-dione has a molecular weight of 115.09 g/mol, XLogP of -0.36, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-methyl-1,3-oxazolidine-2,5-dione is sourced from PubChem (CID 2759968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).