5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide

C9H15N3O4S2 — CID 67218979

IUPAC5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide
SMILESCc1nc(C(N)=O)sc1S(=O)(=O)NC(C)(C)CO
InChIInChI=1S/C9H15N3O4S2/c1-5-8(17-7(11-5)6(10)14)18(15,16)12-9(2,3)4-13/h12-13H,4H2,1-3H3,(H2,10,14)
InChIKeyNLHODSGGPVEZKL-UHFFFAOYSA-N
MW293.37 g/mol
LogP-0.40
Rot. Bonds5

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

5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide (PubChem CID 67218979) has the molecular formula C9H15N3O4S2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound Name5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide
PubChem CID67218979
Molecular FormulaC9H15N3O4S2
Molecular Weight293.37 g/mol
Exact Mass293.05
IUPAC Name5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide
SMILESCc1nc(C(N)=O)sc1S(=O)(=O)NC(C)(C)CO
InChIInChI=1S/C9H15N3O4S2/c1-5-8(17-7(11-5)6(10)14)18(15,16)12-9(2,3)4-13/h12-13H,4H2,1-3H3,(H2,10,14)
InChIKeyNLHODSGGPVEZKL-UHFFFAOYSA-N
XLogP-0.40
TPSA122.38 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 5-0.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
The IUPAC name of 5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide (CID 67218979) is 5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide.
What is the SMILES notation for 5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
The canonical SMILES for 5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide is Cc1nc(C(N)=O)sc1S(=O)(=O)NC(C)(C)CO.
What is the InChIKey of 5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
The InChIKey is NLHODSGGPVEZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O4S2/c1-5-8(17-7(11-5)6(10)14)18(15,16)12-9(2,3)4-13/h12-13H,4H2,1-3H3,(H2,10,14).
What are the key properties of 5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide has a molecular weight of 293.37 g/mol, XLogP of -0.40, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 67218979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).