5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide

C8H13N3O4S2 — CID 67218993

IUPAC5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide
SMILESCc1nc(C(N)=O)sc1S(=O)(=O)N(C)CCO
InChIInChI=1S/C8H13N3O4S2/c1-5-8(16-7(10-5)6(9)13)17(14,15)11(2)3-4-12/h12H,3-4H2,1-2H3,(H2,9,13)
InChIKeyZRFNPIVDACMOHI-UHFFFAOYSA-N
MW279.34 g/mol
LogP-0.84
Rot. Bonds5

About 5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide

5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide (PubChem CID 67218993) has the molecular formula C8H13N3O4S2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound Name5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide
PubChem CID67218993
Molecular FormulaC8H13N3O4S2
Molecular Weight279.34 g/mol
Exact Mass279.03
IUPAC Name5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide
SMILESCc1nc(C(N)=O)sc1S(=O)(=O)N(C)CCO
InChIInChI=1S/C8H13N3O4S2/c1-5-8(16-7(10-5)6(9)13)17(14,15)11(2)3-4-12/h12H,3-4H2,1-2H3,(H2,9,13)
InChIKeyZRFNPIVDACMOHI-UHFFFAOYSA-N
XLogP-0.84
TPSA113.59 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 5-0.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
The IUPAC name of 5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide (CID 67218993) is 5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide.
What is the SMILES notation for 5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
The canonical SMILES for 5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide is Cc1nc(C(N)=O)sc1S(=O)(=O)N(C)CCO.
What is the InChIKey of 5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
The InChIKey is ZRFNPIVDACMOHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O4S2/c1-5-8(16-7(10-5)6(9)13)17(14,15)11(2)3-4-12/h12H,3-4H2,1-2H3,(H2,9,13).
What are the key properties of 5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide has a molecular weight of 279.34 g/mol, XLogP of -0.84, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-hydroxyethyl(methyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 67218993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).