2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide

C8H12N2O4S2 — CID 138558015

IUPAC2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide
SMILESCC(C)(O)c1csc(S(=O)(=O)CC(N)=O)n1
InChIInChI=1S/C8H12N2O4S2/c1-8(2,12)5-3-15-7(10-5)16(13,14)4-6(9)11/h3,12H,4H2,1-2H3,(H2,9,11)
InChIKeyZSLLXAUSGQHRQP-UHFFFAOYSA-N
MW264.33 g/mol
LogP-0.37
Rot. Bonds4

About 2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide

2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide (PubChem CID 138558015) has the molecular formula C8H12N2O4S2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide.

Molecular Properties

Compound Name2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide
PubChem CID138558015
Molecular FormulaC8H12N2O4S2
Molecular Weight264.33 g/mol
Exact Mass264.02
IUPAC Name2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide
SMILESCC(C)(O)c1csc(S(=O)(=O)CC(N)=O)n1
InChIInChI=1S/C8H12N2O4S2/c1-8(2,12)5-3-15-7(10-5)16(13,14)4-6(9)11/h3,12H,4H2,1-2H3,(H2,9,11)
InChIKeyZSLLXAUSGQHRQP-UHFFFAOYSA-N
XLogP-0.37
TPSA110.35 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide?
The IUPAC name of 2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide (CID 138558015) is 2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide.
What is the SMILES notation for 2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide?
The canonical SMILES for 2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide is CC(C)(O)c1csc(S(=O)(=O)CC(N)=O)n1.
What is the InChIKey of 2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide?
The InChIKey is ZSLLXAUSGQHRQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O4S2/c1-8(2,12)5-3-15-7(10-5)16(13,14)4-6(9)11/h3,12H,4H2,1-2H3,(H2,9,11).
What are the key properties of 2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide?
2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide has a molecular weight of 264.33 g/mol, XLogP of -0.37, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide is sourced from PubChem (CID 138558015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).