3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole

C5H9N3O3S — CID 131134640

IUPAC3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole
SMILESCN(Cc1ccon1)S(N)(=O)=O
InChIInChI=1S/C5H9N3O3S/c1-8(12(6,9)10)4-5-2-3-11-7-5/h2-3H,4H2,1H3,(H2,6,9,10)
InChIKeyZGVBYDVOKCJVQI-UHFFFAOYSA-N
MW191.21 g/mol
LogP-0.69
Rot. Bonds3

About 3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole

3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole (PubChem CID 131134640) has the molecular formula C5H9N3O3S and a molecular weight of 191.21 g/mol. Its IUPAC name is 3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole.

Molecular Properties

Compound Name3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole
PubChem CID131134640
Molecular FormulaC5H9N3O3S
Molecular Weight191.21 g/mol
Exact Mass191.04
IUPAC Name3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole
SMILESCN(Cc1ccon1)S(N)(=O)=O
InChIInChI=1S/C5H9N3O3S/c1-8(12(6,9)10)4-5-2-3-11-7-5/h2-3H,4H2,1H3,(H2,6,9,10)
InChIKeyZGVBYDVOKCJVQI-UHFFFAOYSA-N
XLogP-0.69
TPSA89.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.21
LogP ≤ 5-0.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-(1,2-oxazol-3-ylmethyl)sulfamoyl chloride
CID 165491085
N'-methyl-N'-(1,2-oxazol-3-ylmethyl)ethane-1,2-diamine
CID 115869778
N-methyl-N-(1,2-oxazol-3-ylmethyl)acetamide
CID 58166119
N,N-dimethyl-3-(1,2-oxazol-3-yl)propan-1-amine
CID 57052776
2-amino-N,3-dimethyl-N-(1,2-oxazol-3-ylmethyl)butanamide;hydrochloride
CID 119330899
3-(propan-2-ylsulfonylmethyl)-1,2-oxazole
CID 20761928
2-[3-methylbutan-2-yl(1,2-oxazol-3-ylmethyl)amino]ethanesulfonyl fluoride
CID 154881359
(1R)-1-(4-chlorophenyl)-N-methyl-N-(1,2-oxazol-3-ylmethyl)ethanamine
CID 95351075
N-[(2R)-2-hydroxybutyl]-4-[methyl(1,2-oxazol-3-ylmethyl)sulfamoyl]benzamide
CID 97113457
2-bromo-5-[[methyl(sulfamoyl)amino]methyl]furan
CID 112684674
N-methyl-3-(4-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-N-(1,2-oxazol-3-ylmethyl)benzenesulfonamide
CID 77083145
1-hydroxy-4-[[methyl(sulfamoyl)amino]methyl]benzene
CID 112689195

Frequently Asked Questions

What is the IUPAC name of 3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole?
The IUPAC name of 3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole (CID 131134640) is 3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole.
What is the SMILES notation for 3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole?
The canonical SMILES for 3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole is CN(Cc1ccon1)S(N)(=O)=O.
What is the InChIKey of 3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole?
The InChIKey is ZGVBYDVOKCJVQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O3S/c1-8(12(6,9)10)4-5-2-3-11-7-5/h2-3H,4H2,1H3,(H2,6,9,10).
What are the key properties of 3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole?
3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole has a molecular weight of 191.21 g/mol, XLogP of -0.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[methyl(sulfamoyl)amino]methyl]-1,2-oxazole is sourced from PubChem (CID 131134640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).