2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid

C8H10N2O4S — CID 82226333

IUPAC2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid
SMILESCOCC(=O)Nc1nc(C)c(C(=O)O)s1
InChIInChI=1S/C8H10N2O4S/c1-4-6(7(12)13)15-8(9-4)10-5(11)3-14-2/h3H2,1-2H3,(H,12,13)(H,9,10,11)
InChIKeyLXYFZMHCKLGUEE-UHFFFAOYSA-N
MW230.24 g/mol
LogP0.73
Rot. Bonds4

About 2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid

2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid (PubChem CID 82226333) has the molecular formula C8H10N2O4S and a molecular weight of 230.24 g/mol. Its IUPAC name is 2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid.

Molecular Properties

Compound Name2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid
PubChem CID82226333
Molecular FormulaC8H10N2O4S
Molecular Weight230.24 g/mol
Exact Mass230.04
IUPAC Name2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid
SMILESCOCC(=O)Nc1nc(C)c(C(=O)O)s1
InChIInChI=1S/C8H10N2O4S/c1-4-6(7(12)13)15-8(9-4)10-5(11)3-14-2/h3H2,1-2H3,(H,12,13)(H,9,10,11)
InChIKeyLXYFZMHCKLGUEE-UHFFFAOYSA-N
XLogP0.73
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.24
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methyl-2-(3-methylbutanoylamino)-1,3-thiazole-5-carboxylic acid
CID 28803672
4-methyl-2-[(2-phenylacetyl)amino]-1,3-thiazole-5-carboxylic acid
CID 28803701
2-[(2-methoxyacetyl)amino]-4-pyridin-4-yl-1,3-thiazole-5-carboxylic acid
CID 82226599
2-[(2-methoxyacetyl)amino]-4-thiophen-2-yl-1,3-thiazole-5-carboxylic acid
CID 82226534
2-(3-methoxypropylamino)-4-methyl-1,3-thiazole-5-carboxylic acid
CID 9154626
methyl 4-methyl-2-[(2-phenoxyacetyl)amino]-1,3-thiazole-5-carboxylate
CID 647925
2-[(2-methoxyacetyl)amino]-4-(thiophen-2-ylmethyl)-1,3-thiazole-5-carboxylic acid
CID 94970430
N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-2-propan-2-yloxyacetamide
CID 43853851
4-(3-fluorophenyl)-2-[(2-methoxyacetyl)amino]-1,3-thiazole-5-carboxylic acid
CID 94970415
methyl 2-(4-methoxybutanoylamino)-4-methyl-1,3-thiazole-5-carboxylate
CID 55756724
2-(carboxyoxyamino)-4-methyl-1,3-thiazole-5-carboxylic acid
CID 141096674
methyl 2-[(4-methoxy-4-oxobutanoyl)amino]-4-methyl-1,3-thiazole-5-carboxylate
CID 108808756

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid?
The IUPAC name of 2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid (CID 82226333) is 2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid.
What is the SMILES notation for 2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid?
The canonical SMILES for 2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid is COCC(=O)Nc1nc(C)c(C(=O)O)s1.
What is the InChIKey of 2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid?
The InChIKey is LXYFZMHCKLGUEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O4S/c1-4-6(7(12)13)15-8(9-4)10-5(11)3-14-2/h3H2,1-2H3,(H,12,13)(H,9,10,11).
What are the key properties of 2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid?
2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid has a molecular weight of 230.24 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyacetyl)amino]-4-methyl-1,3-thiazole-5-carboxylic acid is sourced from PubChem (CID 82226333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).