N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide

C6H9N3O3S2 — CID 167336881

IUPACN,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide
SMILESCN(C)C(=O)c1ncc(S(N)(=O)=O)s1
InChIInChI=1S/C6H9N3O3S2/c1-9(2)6(10)5-8-3-4(13-5)14(7,11)12/h3H,1-2H3,(H2,7,11,12)
InChIKeyFHKBUBDKTODIHX-UHFFFAOYSA-N
MW235.29 g/mol
LogP-0.51
Rot. Bonds2

About N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide

N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide (PubChem CID 167336881) has the molecular formula C6H9N3O3S2 and a molecular weight of 235.29 g/mol. Its IUPAC name is N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide
PubChem CID167336881
Molecular FormulaC6H9N3O3S2
Molecular Weight235.29 g/mol
Exact Mass235.01
IUPAC NameN,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide
SMILESCN(C)C(=O)c1ncc(S(N)(=O)=O)s1
InChIInChI=1S/C6H9N3O3S2/c1-9(2)6(10)5-8-3-4(13-5)14(7,11)12/h3H,1-2H3,(H2,7,11,12)
InChIKeyFHKBUBDKTODIHX-UHFFFAOYSA-N
XLogP-0.51
TPSA93.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide?
The IUPAC name of N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide (CID 167336881) is N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide?
The canonical SMILES for N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide is CN(C)C(=O)c1ncc(S(N)(=O)=O)s1.
What is the InChIKey of N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide?
The InChIKey is FHKBUBDKTODIHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O3S2/c1-9(2)6(10)5-8-3-4(13-5)14(7,11)12/h3H,1-2H3,(H2,7,11,12).
What are the key properties of N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide?
N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide has a molecular weight of 235.29 g/mol, XLogP of -0.51, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-sulfamoyl-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 167336881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).