4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide

C6H10N2O2S2 — CID 142522573

IUPAC4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide
SMILESCC(C)(O)c1csc(S(N)=O)n1
InChIInChI=1S/C6H10N2O2S2/c1-6(2,9)4-3-11-5(8-4)12(7)10/h3,9H,7H2,1-2H3
InChIKeyLOSQMVVBZOLCNY-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.35
Rot. Bonds2

About 4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide

4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide (PubChem CID 142522573) has the molecular formula C6H10N2O2S2 and a molecular weight of 206.29 g/mol. Its IUPAC name is 4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide.

Molecular Properties

Compound Name4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide
PubChem CID142522573
Molecular FormulaC6H10N2O2S2
Molecular Weight206.29 g/mol
Exact Mass206.02
IUPAC Name4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide
SMILESCC(C)(O)c1csc(S(N)=O)n1
InChIInChI=1S/C6H10N2O2S2/c1-6(2,9)4-3-11-5(8-4)12(7)10/h3,9H,7H2,1-2H3
InChIKeyLOSQMVVBZOLCNY-UHFFFAOYSA-N
XLogP0.35
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide?
The IUPAC name of 4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide (CID 142522573) is 4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide.
What is the SMILES notation for 4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide?
The canonical SMILES for 4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide is CC(C)(O)c1csc(S(N)=O)n1.
What is the InChIKey of 4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide?
The InChIKey is LOSQMVVBZOLCNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2S2/c1-6(2,9)4-3-11-5(8-4)12(7)10/h3,9H,7H2,1-2H3.
What are the key properties of 4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide?
4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide has a molecular weight of 206.29 g/mol, XLogP of 0.35, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxypropan-2-yl)-1,3-thiazole-2-sulfinamide is sourced from PubChem (CID 142522573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).