2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide

C8H12N2OS — CID 130662599

IUPAC2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide
SMILESCCc1nc(CC(=O)NC)cs1
InChIInChI=1S/C8H12N2OS/c1-3-8-10-6(5-12-8)4-7(11)9-2/h5H,3-4H2,1-2H3,(H,9,11)
InChIKeyGNGAGUOOXAPOPT-UHFFFAOYSA-N
MW184.26 g/mol
LogP0.99
Rot. Bonds3

About 2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide

2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide (PubChem CID 130662599) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is 2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide.

Molecular Properties

Compound Name2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide
PubChem CID130662599
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC Name2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide
SMILESCCc1nc(CC(=O)NC)cs1
InChIInChI=1S/C8H12N2OS/c1-3-8-10-6(5-12-8)4-7(11)9-2/h5H,3-4H2,1-2H3,(H,9,11)
InChIKeyGNGAGUOOXAPOPT-UHFFFAOYSA-N
XLogP0.99
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethyl-1,3-thiazol-2-yl)-N-methylacetamide
CID 131039339
2-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-methylacetamide
CID 16768117
2-[[2-(2-ethyl-1,3-thiazol-4-yl)acetyl]amino]butanoic acid
CID 119224070
2-(2-ethyl-1,3-thiazol-4-yl)-N-(1-hydroxybutan-2-yl)acetamide
CID 110903716
2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]-N-methylacetamide
CID 82547688
2-(2-ethyl-1,3-thiazol-4-yl)-N-[[2-(hydroxymethyl)phenyl]methyl]acetamide
CID 47466332
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(2-ethyl-1,3-thiazol-4-yl)acetamide
CID 119606699
2-(2-ethyl-1,3-thiazol-4-yl)-N-pyrrolidin-3-ylacetamide;dihydrochloride
CID 119451077
2-(2-ethyl-1,3-thiazol-4-yl)-N-(3-phenylprop-2-ynyl)acetamide
CID 47378517
2-[[[2-(2-ethyl-1,3-thiazol-4-yl)acetyl]amino]methyl]-4-methylpentanoic acid
CID 119253619
2-(2-ethyl-1,3-thiazol-4-yl)-N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)acetamide
CID 111436192
2-(2-ethyl-1,3-thiazol-4-yl)-N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]acetamide
CID 111697089

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide?
The IUPAC name of 2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide (CID 130662599) is 2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide.
What is the SMILES notation for 2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide?
The canonical SMILES for 2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide is CCc1nc(CC(=O)NC)cs1.
What is the InChIKey of 2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide?
The InChIKey is GNGAGUOOXAPOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-3-8-10-6(5-12-8)4-7(11)9-2/h5H,3-4H2,1-2H3,(H,9,11).
What are the key properties of 2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide?
2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide has a molecular weight of 184.26 g/mol, XLogP of 0.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-1,3-thiazol-4-yl)-N-methylacetamide is sourced from PubChem (CID 130662599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).