ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate

C12H15N3O6S — CID 71210055

IUPACethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate
SMILESCCOC(=O)Cc1cccc(NS(=O)(=O)N2CCOC2=O)n1
InChIInChI=1S/C12H15N3O6S/c1-2-20-11(16)8-9-4-3-5-10(13-9)14-22(18,19)15-6-7-21-12(15)17/h3-5H,2,6-8H2,1H3,(H,13,14)
InChIKeyGEEBDGHGLLTXJU-UHFFFAOYSA-N
MW329.33 g/mol
LogP0.30
Rot. Bonds6

About ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate

ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate (PubChem CID 71210055) has the molecular formula C12H15N3O6S and a molecular weight of 329.33 g/mol. Its IUPAC name is ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate.

Molecular Properties

Compound Nameethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate
PubChem CID71210055
Molecular FormulaC12H15N3O6S
Molecular Weight329.33 g/mol
Exact Mass329.07
IUPAC Nameethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate
SMILESCCOC(=O)Cc1cccc(NS(=O)(=O)N2CCOC2=O)n1
InChIInChI=1S/C12H15N3O6S/c1-2-20-11(16)8-9-4-3-5-10(13-9)14-22(18,19)15-6-7-21-12(15)17/h3-5H,2,6-8H2,1H3,(H,13,14)
InChIKeyGEEBDGHGLLTXJU-UHFFFAOYSA-N
XLogP0.30
TPSA114.90 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.33
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate?
The IUPAC name of ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate (CID 71210055) is ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate.
What is the SMILES notation for ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate?
The canonical SMILES for ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate is CCOC(=O)Cc1cccc(NS(=O)(=O)N2CCOC2=O)n1.
What is the InChIKey of ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate?
The InChIKey is GEEBDGHGLLTXJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O6S/c1-2-20-11(16)8-9-4-3-5-10(13-9)14-22(18,19)15-6-7-21-12(15)17/h3-5H,2,6-8H2,1H3,(H,13,14).
What are the key properties of ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate?
ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate has a molecular weight of 329.33 g/mol, XLogP of 0.30, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[6-[(2-oxo-1,3-oxazolidin-3-yl)sulfonylamino]-2-pyridinyl]acetate is sourced from PubChem (CID 71210055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).