2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid

C6H7NO5 — CID 86707728

IUPAC2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid
SMILESC[C@]1(CC(=O)O)OC(=O)NC1=O
InChIInChI=1S/C6H7NO5/c1-6(2-3(8)9)4(10)7-5(11)12-6/h2H2,1H3,(H,8,9)(H,7,10,11)/t6-/m1/s1
InChIKeyCGMMTQFRSMFDMA-ZCFIWIBFSA-N
MW173.12 g/mol
LogP-0.51
Rot. Bonds2

About 2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid

2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid (PubChem CID 86707728) has the molecular formula C6H7NO5 and a molecular weight of 173.12 g/mol. Its IUPAC name is 2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid.

Molecular Properties

Compound Name2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid
PubChem CID86707728
Molecular FormulaC6H7NO5
Molecular Weight173.12 g/mol
Exact Mass173.03
IUPAC Name2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid
SMILESC[C@]1(CC(=O)O)OC(=O)NC1=O
InChIInChI=1S/C6H7NO5/c1-6(2-3(8)9)4(10)7-5(11)12-6/h2H2,1H3,(H,8,9)(H,7,10,11)/t6-/m1/s1
InChIKeyCGMMTQFRSMFDMA-ZCFIWIBFSA-N
XLogP-0.51
TPSA92.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.12
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid?
The IUPAC name of 2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid (CID 86707728) is 2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid.
What is the SMILES notation for 2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid?
The canonical SMILES for 2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid is C[C@]1(CC(=O)O)OC(=O)NC1=O.
What is the InChIKey of 2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid?
The InChIKey is CGMMTQFRSMFDMA-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H7NO5/c1-6(2-3(8)9)4(10)7-5(11)12-6/h2H2,1H3,(H,8,9)(H,7,10,11)/t6-/m1/s1.
What are the key properties of 2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid?
2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid has a molecular weight of 173.12 g/mol, XLogP of -0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5R)-5-methyl-2,4-dioxo-1,3-oxazolidin-5-yl]acetic acid is sourced from PubChem (CID 86707728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).