2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid

C7H10N2O5S — CID 104570121

IUPAC2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid
SMILESO=C(O)CSCC(=O)N[C@@H]1CONC1=O
InChIInChI=1S/C7H10N2O5S/c10-5(2-15-3-6(11)12)8-4-1-14-9-7(4)13/h4H,1-3H2,(H,8,10)(H,9,13)(H,11,12)/t4-/m1/s1
InChIKeyDXWFDGNWXNRXQQ-SCSAIBSYSA-N
MW234.23 g/mol
LogP-1.65
Rot. Bonds5

About 2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid

2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid (PubChem CID 104570121) has the molecular formula C7H10N2O5S and a molecular weight of 234.23 g/mol. Its IUPAC name is 2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid.

Molecular Properties

Compound Name2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid
PubChem CID104570121
Molecular FormulaC7H10N2O5S
Molecular Weight234.23 g/mol
Exact Mass234.03
IUPAC Name2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid
SMILESO=C(O)CSCC(=O)N[C@@H]1CONC1=O
InChIInChI=1S/C7H10N2O5S/c10-5(2-15-3-6(11)12)8-4-1-14-9-7(4)13/h4H,1-3H2,(H,8,10)(H,9,13)(H,11,12)/t4-/m1/s1
InChIKeyDXWFDGNWXNRXQQ-SCSAIBSYSA-N
XLogP-1.65
TPSA104.73 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.23
LogP ≤ 5-1.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid?
The IUPAC name of 2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid (CID 104570121) is 2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid.
What is the SMILES notation for 2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid?
The canonical SMILES for 2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid is O=C(O)CSCC(=O)N[C@@H]1CONC1=O.
What is the InChIKey of 2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid?
The InChIKey is DXWFDGNWXNRXQQ-SCSAIBSYSA-N. The full InChI is InChI=1S/C7H10N2O5S/c10-5(2-15-3-6(11)12)8-4-1-14-9-7(4)13/h4H,1-3H2,(H,8,10)(H,9,13)(H,11,12)/t4-/m1/s1.
What are the key properties of 2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid?
2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid has a molecular weight of 234.23 g/mol, XLogP of -1.65, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-oxo-2-[[(4R)-3-oxo-1,2-oxazolidin-4-yl]amino]ethyl]sulfanylacetic acid is sourced from PubChem (CID 104570121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).