N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide

C9H10N2O3S — CID 67901987

IUPACN-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide
SMILESCC(=O)N(c1cccs1)[C@H]1CONC1=O
InChIInChI=1S/C9H10N2O3S/c1-6(12)11(8-3-2-4-15-8)7-5-14-10-9(7)13/h2-4,7H,5H2,1H3,(H,10,13)/t7-/m0/s1
InChIKeyHQJXEZPIVVSPPG-ZETCQYMHSA-N
MW226.26 g/mol
LogP0.53
Rot. Bonds2

About N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide

N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide (PubChem CID 67901987) has the molecular formula C9H10N2O3S and a molecular weight of 226.26 g/mol. Its IUPAC name is N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide
PubChem CID67901987
Molecular FormulaC9H10N2O3S
Molecular Weight226.26 g/mol
Exact Mass226.04
IUPAC NameN-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide
SMILESCC(=O)N(c1cccs1)[C@H]1CONC1=O
InChIInChI=1S/C9H10N2O3S/c1-6(12)11(8-3-2-4-15-8)7-5-14-10-9(7)13/h2-4,7H,5H2,1H3,(H,10,13)/t7-/m0/s1
InChIKeyHQJXEZPIVVSPPG-ZETCQYMHSA-N
XLogP0.53
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.26
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide?
The IUPAC name of N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide (CID 67901987) is N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide.
What is the SMILES notation for N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide?
The canonical SMILES for N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide is CC(=O)N(c1cccs1)[C@H]1CONC1=O.
What is the InChIKey of N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide?
The InChIKey is HQJXEZPIVVSPPG-ZETCQYMHSA-N. The full InChI is InChI=1S/C9H10N2O3S/c1-6(12)11(8-3-2-4-15-8)7-5-14-10-9(7)13/h2-4,7H,5H2,1H3,(H,10,13)/t7-/m0/s1.
What are the key properties of N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide?
N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide has a molecular weight of 226.26 g/mol, XLogP of 0.53, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4S)-3-oxo-1,2-oxazolidin-4-yl]-N-thiophen-2-ylacetamide is sourced from PubChem (CID 67901987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).