1,3-oxazole-2-sulfonamide

C3H4N2O3S — CID 54424983

IUPAC1,3-oxazole-2-sulfonamide
SMILESNS(=O)(=O)c1ncco1
InChIInChI=1S/C3H4N2O3S/c4-9(6,7)3-5-1-2-8-3/h1-2H,(H2,4,6,7)
InChIKeyQHZVYZZRMVDSRK-UHFFFAOYSA-N
MW148.14 g/mol
LogP-0.68
Rot. Bonds1

About 1,3-oxazole-2-sulfonamide

1,3-oxazole-2-sulfonamide (PubChem CID 54424983) has the molecular formula C3H4N2O3S and a molecular weight of 148.14 g/mol. Its IUPAC name is 1,3-oxazole-2-sulfonamide.

Molecular Properties

Compound Name1,3-oxazole-2-sulfonamide
PubChem CID54424983
Molecular FormulaC3H4N2O3S
Molecular Weight148.14 g/mol
Exact Mass147.99
IUPAC Name1,3-oxazole-2-sulfonamide
SMILESNS(=O)(=O)c1ncco1
InChIInChI=1S/C3H4N2O3S/c4-9(6,7)3-5-1-2-8-3/h1-2H,(H2,4,6,7)
InChIKeyQHZVYZZRMVDSRK-UHFFFAOYSA-N
XLogP-0.68
TPSA86.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.14
LogP ≤ 5-0.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

benzene;1,3-oxazole-2-sulfonic acid
CID 175144268
trimethyl(1,3-oxazol-2-yl)-λ4-sulfane
CID 90872919
2-pyridin-2-ylsulfonyl-1,3-oxazole
CID 175524122
2-phosphoroso-1,3-oxazole
CID 174296677
2-(dideuteriomethyl)-1,3-oxazole
CID 167525558
2-[2-(1,3-oxazol-2-yl)ethynyl]-1,3-oxazole
CID 90278010
5-(4-chlorophenyl)-2-methyl-4-(1,3-oxazol-2-yl)benzenesulfonamide
CID 67622969
2-amino-N-(1,3-oxazol-2-yl)benzenesulfonamide
CID 154131692
[3-(4-sulfamoylphenyl)phenyl] 1,3-oxazole-2-carboxylate
CID 18701817
(1S)-1-(1,3-oxazol-2-yl)ethanamine
CID 28924825
1,2,4-oxadiazole-3-sulfonamide
CID 19939751
carbon dioxide;2-ethynyl-1,3-oxazole
CID 159343815

Frequently Asked Questions

What is the IUPAC name of 1,3-oxazole-2-sulfonamide?
The IUPAC name of 1,3-oxazole-2-sulfonamide (CID 54424983) is 1,3-oxazole-2-sulfonamide.
What is the SMILES notation for 1,3-oxazole-2-sulfonamide?
The canonical SMILES for 1,3-oxazole-2-sulfonamide is NS(=O)(=O)c1ncco1.
What is the InChIKey of 1,3-oxazole-2-sulfonamide?
The InChIKey is QHZVYZZRMVDSRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2O3S/c4-9(6,7)3-5-1-2-8-3/h1-2H,(H2,4,6,7).
What are the key properties of 1,3-oxazole-2-sulfonamide?
1,3-oxazole-2-sulfonamide has a molecular weight of 148.14 g/mol, XLogP of -0.68, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-oxazole-2-sulfonamide is sourced from PubChem (CID 54424983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).