2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide

C8H12N2O2S — CID 43853845

IUPAC2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide
SMILESCC(C)OCC(=O)Nc1nccs1
InChIInChI=1S/C8H12N2O2S/c1-6(2)12-5-7(11)10-8-9-3-4-13-8/h3-4,6H,5H2,1-2H3,(H,9,10,11)
InChIKeyOXUPIIKTEQGBMY-UHFFFAOYSA-N
MW200.26 g/mol
LogP1.51
Rot. Bonds4

About 2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide

2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 43853845) has the molecular formula C8H12N2O2S and a molecular weight of 200.26 g/mol. Its IUPAC name is 2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide
PubChem CID43853845
Molecular FormulaC8H12N2O2S
Molecular Weight200.26 g/mol
Exact Mass200.06
IUPAC Name2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide
SMILESCC(C)OCC(=O)Nc1nccs1
InChIInChI=1S/C8H12N2O2S/c1-6(2)12-5-7(11)10-8-9-3-4-13-8/h3-4,6H,5H2,1-2H3,(H,9,10,11)
InChIKeyOXUPIIKTEQGBMY-UHFFFAOYSA-N
XLogP1.51
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.26
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide (CID 43853845) is 2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide is CC(C)OCC(=O)Nc1nccs1.
What is the InChIKey of 2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is OXUPIIKTEQGBMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2S/c1-6(2)12-5-7(11)10-8-9-3-4-13-8/h3-4,6H,5H2,1-2H3,(H,9,10,11).
What are the key properties of 2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide?
2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 200.26 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yloxy-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 43853845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).