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

C9H15N3O5S2 — CID 69217030

IUPAC5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide
SMILESCc1nc(C(N)=O)sc1S(=O)(=O)N(CCO)CCO
InChIInChI=1S/C9H15N3O5S2/c1-6-9(18-8(11-6)7(10)15)19(16,17)12(2-4-13)3-5-14/h13-14H,2-5H2,1H3,(H2,10,15)
InChIKeyFHTWBGIAOPUXDB-UHFFFAOYSA-N
MW309.37 g/mol
LogP-1.47
Rot. Bonds7

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

5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide (PubChem CID 69217030) has the molecular formula C9H15N3O5S2 and a molecular weight of 309.37 g/mol. Its IUPAC name is 5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound Name5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide
PubChem CID69217030
Molecular FormulaC9H15N3O5S2
Molecular Weight309.37 g/mol
Exact Mass309.05
IUPAC Name5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide
SMILESCc1nc(C(N)=O)sc1S(=O)(=O)N(CCO)CCO
InChIInChI=1S/C9H15N3O5S2/c1-6-9(18-8(11-6)7(10)15)19(16,17)12(2-4-13)3-5-14/h13-14H,2-5H2,1H3,(H2,10,15)
InChIKeyFHTWBGIAOPUXDB-UHFFFAOYSA-N
XLogP-1.47
TPSA133.82 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 5-1.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
The IUPAC name of 5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide (CID 69217030) is 5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide.
What is the SMILES notation for 5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
The canonical SMILES for 5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide is Cc1nc(C(N)=O)sc1S(=O)(=O)N(CCO)CCO.
What is the InChIKey of 5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
The InChIKey is FHTWBGIAOPUXDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O5S2/c1-6-9(18-8(11-6)7(10)15)19(16,17)12(2-4-13)3-5-14/h13-14H,2-5H2,1H3,(H2,10,15).
What are the key properties of 5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide?
5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide has a molecular weight of 309.37 g/mol, XLogP of -1.47, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[bis(2-hydroxyethyl)sulfamoyl]-4-methyl-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 69217030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).