N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide

C8H12N2O3S — CID 90851231

IUPACN-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide
SMILESCC(=O)NCCn1c(O)c(C)sc1=O
InChIInChI=1S/C8H12N2O3S/c1-5-7(12)10(8(13)14-5)4-3-9-6(2)11/h12H,3-4H2,1-2H3,(H,9,11)
InChIKeyBQPDIPWOXFMYPQ-UHFFFAOYSA-N
MW216.26 g/mol
LogP0.06
Rot. Bonds3

About N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide

N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide (PubChem CID 90851231) has the molecular formula C8H12N2O3S and a molecular weight of 216.26 g/mol. Its IUPAC name is N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide
PubChem CID90851231
Molecular FormulaC8H12N2O3S
Molecular Weight216.26 g/mol
Exact Mass216.06
IUPAC NameN-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide
SMILESCC(=O)NCCn1c(O)c(C)sc1=O
InChIInChI=1S/C8H12N2O3S/c1-5-7(12)10(8(13)14-5)4-3-9-6(2)11/h12H,3-4H2,1-2H3,(H,9,11)
InChIKeyBQPDIPWOXFMYPQ-UHFFFAOYSA-N
XLogP0.06
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.26
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide?
The IUPAC name of N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide (CID 90851231) is N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide is CC(=O)NCCn1c(O)c(C)sc1=O.
What is the InChIKey of N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide?
The InChIKey is BQPDIPWOXFMYPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3S/c1-5-7(12)10(8(13)14-5)4-3-9-6(2)11/h12H,3-4H2,1-2H3,(H,9,11).
What are the key properties of N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide?
N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide has a molecular weight of 216.26 g/mol, XLogP of 0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxy-5-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]acetamide is sourced from PubChem (CID 90851231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).