1,2-oxazolidine-2-sulfonamide

C3H8N2O3S — CID 68860705

IUPAC1,2-oxazolidine-2-sulfonamide
SMILESNS(=O)(=O)N1CCCO1
InChIInChI=1S/C3H8N2O3S/c4-9(6,7)5-2-1-3-8-5/h1-3H2,(H2,4,6,7)
InChIKeyCSYOIFVEEVUMDF-UHFFFAOYSA-N
MW152.17 g/mol
LogP-1.17
Rot. Bonds1

About 1,2-oxazolidine-2-sulfonamide

1,2-oxazolidine-2-sulfonamide (PubChem CID 68860705) has the molecular formula C3H8N2O3S and a molecular weight of 152.17 g/mol. Its IUPAC name is 1,2-oxazolidine-2-sulfonamide.

Molecular Properties

Compound Name1,2-oxazolidine-2-sulfonamide
PubChem CID68860705
Molecular FormulaC3H8N2O3S
Molecular Weight152.17 g/mol
Exact Mass152.03
IUPAC Name1,2-oxazolidine-2-sulfonamide
SMILESNS(=O)(=O)N1CCCO1
InChIInChI=1S/C3H8N2O3S/c4-9(6,7)5-2-1-3-8-5/h1-3H2,(H2,4,6,7)
InChIKeyCSYOIFVEEVUMDF-UHFFFAOYSA-N
XLogP-1.17
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.17
LogP ≤ 5-1.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2-oxazolidine-2-sulfonamide?
The IUPAC name of 1,2-oxazolidine-2-sulfonamide (CID 68860705) is 1,2-oxazolidine-2-sulfonamide.
What is the SMILES notation for 1,2-oxazolidine-2-sulfonamide?
The canonical SMILES for 1,2-oxazolidine-2-sulfonamide is NS(=O)(=O)N1CCCO1.
What is the InChIKey of 1,2-oxazolidine-2-sulfonamide?
The InChIKey is CSYOIFVEEVUMDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N2O3S/c4-9(6,7)5-2-1-3-8-5/h1-3H2,(H2,4,6,7).
What are the key properties of 1,2-oxazolidine-2-sulfonamide?
1,2-oxazolidine-2-sulfonamide has a molecular weight of 152.17 g/mol, XLogP of -1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-oxazolidine-2-sulfonamide is sourced from PubChem (CID 68860705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).