N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide

C12H12N2O3S — CID 2903852

IUPACN-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide
SMILESCC1SC(NC(=O)COc2ccccc2)=NC1=O
InChIInChI=1S/C12H12N2O3S/c1-8-11(16)14-12(18-8)13-10(15)7-17-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,13,14,15,16)
InChIKeyWHUJJIXJIJPSLT-UHFFFAOYSA-N
MW264.31 g/mol
LogP1.20
Rot. Bonds3

About N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide

N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide (PubChem CID 2903852) has the molecular formula C12H12N2O3S and a molecular weight of 264.31 g/mol. Its IUPAC name is N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide
PubChem CID2903852
Molecular FormulaC12H12N2O3S
Molecular Weight264.31 g/mol
Exact Mass264.06
IUPAC NameN-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide
SMILESCC1SC(NC(=O)COc2ccccc2)=NC1=O
InChIInChI=1S/C12H12N2O3S/c1-8-11(16)14-12(18-8)13-10(15)7-17-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,13,14,15,16)
InChIKeyWHUJJIXJIJPSLT-UHFFFAOYSA-N
XLogP1.20
TPSA67.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide?
The IUPAC name of N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide (CID 2903852) is N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide.
What is the SMILES notation for N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide?
The canonical SMILES for N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide is CC1SC(NC(=O)COc2ccccc2)=NC1=O.
What is the InChIKey of N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide?
The InChIKey is WHUJJIXJIJPSLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3S/c1-8-11(16)14-12(18-8)13-10(15)7-17-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,13,14,15,16).
What are the key properties of N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide?
N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide has a molecular weight of 264.31 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-4-oxo-1,3-thiazol-2-yl)-2-phenoxyacetamide is sourced from PubChem (CID 2903852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).