Sulfo nyloxazolidine

C3H5NO3S — CID 22439278

IUPAC2-sulfonyl-1,3-oxazolidine
SMILESO=S(=O)=C1NCCO1
InChIInChI=1S/C3H5NO3S/c5-8(6)3-4-1-2-7-3/h4H,1-2H2
InChIKeyRLEDYQKMMUAHPR-UHFFFAOYSA-N
MW135.14 g/mol
LogP-1.43
Rot. Bonds

About Sulfo nyloxazolidine

Sulfo nyloxazolidine (PubChem CID 22439278) has the molecular formula C3H5NO3S and a molecular weight of 135.14 g/mol. Its IUPAC name is 2-sulfonyl-1,3-oxazolidine.

Molecular Properties

Compound NameSulfo nyloxazolidine
PubChem CID22439278
Molecular FormulaC3H5NO3S
Molecular Weight135.14 g/mol
Exact Mass135.00
IUPAC Name2-sulfonyl-1,3-oxazolidine
SMILESO=S(=O)=C1NCCO1
InChIInChI=1S/C3H5NO3S/c5-8(6)3-4-1-2-7-3/h4H,1-2H2
InChIKeyRLEDYQKMMUAHPR-UHFFFAOYSA-N
XLogP-1.43
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.14
LogP ≤ 5-1.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of Sulfo nyloxazolidine?
The IUPAC name of Sulfo nyloxazolidine (CID 22439278) is 2-sulfonyl-1,3-oxazolidine.
What is the SMILES notation for Sulfo nyloxazolidine?
The canonical SMILES for Sulfo nyloxazolidine is O=S(=O)=C1NCCO1.
What is the InChIKey of Sulfo nyloxazolidine?
The InChIKey is RLEDYQKMMUAHPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5NO3S/c5-8(6)3-4-1-2-7-3/h4H,1-2H2.
What are the key properties of Sulfo nyloxazolidine?
Sulfo nyloxazolidine has a molecular weight of 135.14 g/mol, XLogP of -1.43, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for Sulfo nyloxazolidine is sourced from PubChem (CID 22439278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).