(4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid

C5H7NO4 — CID 55301035

IUPAC(4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid
SMILESC[C@]1(C(=O)O)COC(=O)N1
InChIInChI=1S/C5H7NO4/c1-5(3(7)8)2-10-4(9)6-5/h2H2,1H3,(H,6,9)(H,7,8)/t5-/m1/s1
InChIKeyUTUCVJYDXFKAKO-RXMQYKEDSA-N
MW145.11 g/mol
LogP-0.43
Rot. Bonds1

About (4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid

(4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid (PubChem CID 55301035) has the molecular formula C5H7NO4 and a molecular weight of 145.11 g/mol. Its IUPAC name is (4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid.

Molecular Properties

Compound Name(4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid
PubChem CID55301035
Molecular FormulaC5H7NO4
Molecular Weight145.11 g/mol
Exact Mass145.04
IUPAC Name(4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid
SMILESC[C@]1(C(=O)O)COC(=O)N1
InChIInChI=1S/C5H7NO4/c1-5(3(7)8)2-10-4(9)6-5/h2H2,1H3,(H,6,9)(H,7,8)/t5-/m1/s1
InChIKeyUTUCVJYDXFKAKO-RXMQYKEDSA-N
XLogP-0.43
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.11
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid?
The IUPAC name of (4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid (CID 55301035) is (4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid.
What is the SMILES notation for (4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid?
The canonical SMILES for (4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid is C[C@]1(C(=O)O)COC(=O)N1.
What is the InChIKey of (4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid?
The InChIKey is UTUCVJYDXFKAKO-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H7NO4/c1-5(3(7)8)2-10-4(9)6-5/h2H2,1H3,(H,6,9)(H,7,8)/t5-/m1/s1.
What are the key properties of (4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid?
(4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid has a molecular weight of 145.11 g/mol, XLogP of -0.43, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid is sourced from PubChem (CID 55301035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).