3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one

C10H11NO3S — CID 135041067

IUPAC3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one
SMILESC[C@@H](C(=O)N1CCOC1=O)c1ccsc1
InChIInChI=1S/C10H11NO3S/c1-7(8-2-5-15-6-8)9(12)11-3-4-14-10(11)13/h2,5-7H,3-4H2,1H3/t7-/m1/s1
InChIKeyVOZBINQGOOKGJC-SSDOTTSWSA-N
MW225.27 g/mol
LogP1.83
Rot. Bonds2

About 3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one

3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one (PubChem CID 135041067) has the molecular formula C10H11NO3S and a molecular weight of 225.27 g/mol. Its IUPAC name is 3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one
PubChem CID135041067
Molecular FormulaC10H11NO3S
Molecular Weight225.27 g/mol
Exact Mass225.05
IUPAC Name3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one
SMILESC[C@@H](C(=O)N1CCOC1=O)c1ccsc1
InChIInChI=1S/C10H11NO3S/c1-7(8-2-5-15-6-8)9(12)11-3-4-14-10(11)13/h2,5-7H,3-4H2,1H3/t7-/m1/s1
InChIKeyVOZBINQGOOKGJC-SSDOTTSWSA-N
XLogP1.83
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one (CID 135041067) is 3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one is C[C@@H](C(=O)N1CCOC1=O)c1ccsc1.
What is the InChIKey of 3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one?
The InChIKey is VOZBINQGOOKGJC-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H11NO3S/c1-7(8-2-5-15-6-8)9(12)11-3-4-14-10(11)13/h2,5-7H,3-4H2,1H3/t7-/m1/s1.
What are the key properties of 3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one?
3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one has a molecular weight of 225.27 g/mol, XLogP of 1.83, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R)-2-thiophen-3-ylpropanoyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 135041067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).