2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide

C7H10N2O3S2 — CID 22406979

IUPAC2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide
SMILESNS(=O)(=O)c1cnc(C(O)C2CC2)s1
InChIInChI=1S/C7H10N2O3S2/c8-14(11,12)5-3-9-7(13-5)6(10)4-1-2-4/h3-4,6,10H,1-2H2,(H2,8,11,12)
InChIKeyGFZKXEOTMYVBOD-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.23
Rot. Bonds3

About 2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide

2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide (PubChem CID 22406979) has the molecular formula C7H10N2O3S2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide
PubChem CID22406979
Molecular FormulaC7H10N2O3S2
Molecular Weight234.30 g/mol
Exact Mass234.01
IUPAC Name2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide
SMILESNS(=O)(=O)c1cnc(C(O)C2CC2)s1
InChIInChI=1S/C7H10N2O3S2/c8-14(11,12)5-3-9-7(13-5)6(10)4-1-2-4/h3-4,6,10H,1-2H2,(H2,8,11,12)
InChIKeyGFZKXEOTMYVBOD-UHFFFAOYSA-N
XLogP0.23
TPSA93.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide (CID 22406979) is 2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide is NS(=O)(=O)c1cnc(C(O)C2CC2)s1.
What is the InChIKey of 2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide?
The InChIKey is GFZKXEOTMYVBOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3S2/c8-14(11,12)5-3-9-7(13-5)6(10)4-1-2-4/h3-4,6,10H,1-2H2,(H2,8,11,12).
What are the key properties of 2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide?
2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide has a molecular weight of 234.30 g/mol, XLogP of 0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(hydroxy)methyl]-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 22406979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).