(2R)-1,3-oxazolidine-2-carboxylic acid

C4H7NO3 — CID 69270912

IUPAC(2R)-1,3-oxazolidine-2-carboxylic acid
SMILESO=C(O)[C@@H]1NCCO1
InChIInChI=1S/C4H7NO3/c6-4(7)3-5-1-2-8-3/h3,5H,1-2H2,(H,6,7)/t3-/m1/s1
InChIKeyKNWCDYSKJSREAQ-GSVOUGTGSA-N
MW117.10 g/mol
LogP-0.98
Rot. Bonds1

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

(2R)-1,3-oxazolidine-2-carboxylic acid (PubChem CID 69270912) has the molecular formula C4H7NO3 and a molecular weight of 117.10 g/mol. Its IUPAC name is (2R)-1,3-oxazolidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-1,3-oxazolidine-2-carboxylic acid
PubChem CID69270912
Molecular FormulaC4H7NO3
Molecular Weight117.10 g/mol
Exact Mass117.04
IUPAC Name(2R)-1,3-oxazolidine-2-carboxylic acid
SMILESO=C(O)[C@@H]1NCCO1
InChIInChI=1S/C4H7NO3/c6-4(7)3-5-1-2-8-3/h3,5H,1-2H2,(H,6,7)/t3-/m1/s1
InChIKeyKNWCDYSKJSREAQ-GSVOUGTGSA-N
XLogP-0.98
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.10
LogP ≤ 5-0.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-1,3-oxazinane-2-carboxylic acid
CID 142515360
2-(1,3-oxazolidin-2-yl)-2-oxoacetic acid
CID 174974920
2-chloro-1-(1,3-oxazolidin-2-yl)ethanone
CID 23220108
1,3-oxazolidin-2-yl(phenyl)methanone
CID 154118649
2-(1,3-oxazolidin-2-ylmethyl)prop-2-enoic acid
CID 68522926
1,3-oxazinan-2-yl(phenyl)methanone
CID 121217862
(3S)-morpholine-3-carboxylic acid;hydrochloride
CID 42614332
N,2-dimethylmorpholine-3-carboxamide
CID 131024914
ethane;morpholine-3-carboxylic acid
CID 144576497
ethane;morpholine-2-carboxylic acid
CID 170608685
methyl 2-methylmorpholine-3-carboxylate;hydrochloride
CID 138113042
3-sulfanylidenemorpholine-2-carboxylic acid
CID 3037096

Frequently Asked Questions

What is the IUPAC name of (2R)-1,3-oxazolidine-2-carboxylic acid?
The IUPAC name of (2R)-1,3-oxazolidine-2-carboxylic acid (CID 69270912) is (2R)-1,3-oxazolidine-2-carboxylic acid.
What is the SMILES notation for (2R)-1,3-oxazolidine-2-carboxylic acid?
The canonical SMILES for (2R)-1,3-oxazolidine-2-carboxylic acid is O=C(O)[C@@H]1NCCO1.
What is the InChIKey of (2R)-1,3-oxazolidine-2-carboxylic acid?
The InChIKey is KNWCDYSKJSREAQ-GSVOUGTGSA-N. The full InChI is InChI=1S/C4H7NO3/c6-4(7)3-5-1-2-8-3/h3,5H,1-2H2,(H,6,7)/t3-/m1/s1.
What are the key properties of (2R)-1,3-oxazolidine-2-carboxylic acid?
(2R)-1,3-oxazolidine-2-carboxylic acid has a molecular weight of 117.10 g/mol, XLogP of -0.98, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,3-oxazolidine-2-carboxylic acid is sourced from PubChem (CID 69270912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).