N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide

C6H9N3O3S2 — CID 3244062

IUPACN-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)Nc1nc(C)c(S(N)(=O)=O)s1
InChIInChI=1S/C6H9N3O3S2/c1-3-5(14(7,11)12)13-6(8-3)9-4(2)10/h1-2H3,(H2,7,11,12)(H,8,9,10)
InChIKeyLXASOSGTNFQNER-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.06
Rot. Bonds2

About N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide

N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide (PubChem CID 3244062) has the molecular formula C6H9N3O3S2 and a molecular weight of 235.29 g/mol. Its IUPAC name is N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide
PubChem CID3244062
Molecular FormulaC6H9N3O3S2
Molecular Weight235.29 g/mol
Exact Mass235.01
IUPAC NameN-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)Nc1nc(C)c(S(N)(=O)=O)s1
InChIInChI=1S/C6H9N3O3S2/c1-3-5(14(7,11)12)13-6(8-3)9-4(2)10/h1-2H3,(H2,7,11,12)(H,8,9,10)
InChIKeyLXASOSGTNFQNER-UHFFFAOYSA-N
XLogP0.06
TPSA102.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide (CID 3244062) is N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide is CC(=O)Nc1nc(C)c(S(N)(=O)=O)s1.
What is the InChIKey of N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is LXASOSGTNFQNER-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O3S2/c1-3-5(14(7,11)12)13-6(8-3)9-4(2)10/h1-2H3,(H2,7,11,12)(H,8,9,10).
What are the key properties of N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide?
N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 235.29 g/mol, XLogP of 0.06, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 3244062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).