6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid

C9H10N2O3S — CID 107511744

IUPAC6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESCOCc1nc2scc(C)n2c1C(=O)O
InChIInChI=1S/C9H10N2O3S/c1-5-4-15-9-10-6(3-14-2)7(8(12)13)11(5)9/h4H,3H2,1-2H3,(H,12,13)
InChIKeyYHNOMVRZVYISQF-UHFFFAOYSA-N
MW226.26 g/mol
LogP1.55
Rot. Bonds3

About 6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid

6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid (PubChem CID 107511744) has the molecular formula C9H10N2O3S and a molecular weight of 226.26 g/mol. Its IUPAC name is 6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid.

Molecular Properties

Compound Name6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
PubChem CID107511744
Molecular FormulaC9H10N2O3S
Molecular Weight226.26 g/mol
Exact Mass226.04
IUPAC Name6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESCOCc1nc2scc(C)n2c1C(=O)O
InChIInChI=1S/C9H10N2O3S/c1-5-4-15-9-10-6(3-14-2)7(8(12)13)11(5)9/h4H,3H2,1-2H3,(H,12,13)
InChIKeyYHNOMVRZVYISQF-UHFFFAOYSA-N
XLogP1.55
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.26
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)-2-oxoacetic acid
CID 96604955
2-(methoxymethyl)-6-methylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 82530207
2-(methoxymethyl)imidazo[1,2-a]pyrazine-3-carboxylic acid
CID 107511755
(2S)-2-[(3-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methoxy]propanoic acid
CID 104876458
methyl N-[(Z)-(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylideneamino]carbamate
CID 9075334
2-(4-bromothiophen-2-yl)-4-(methoxymethyl)-1,3-thiazole-5-carboxylic acid
CID 114360066
3-(4-tert-butylphenyl)-6-propylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 82035482
4-(methoxymethyl)-2-pyridin-4-yl-1,3-thiazole-5-carboxylic acid
CID 82227122
methyl 3-[(3,7-dimethyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)amino]-3-oxopropanoate
CID 53019399
2-(methoxymethyl)-7-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 82529869
4-(methoxymethyl)-2-(1,3-thiazol-4-yl)-1,3-thiazole-5-carboxylic acid
CID 114359943
[4-(methoxymethyl)-1,3-thiazol-2-yl]carbamic acid
CID 87285914

Frequently Asked Questions

What is the IUPAC name of 6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The IUPAC name of 6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid (CID 107511744) is 6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid.
What is the SMILES notation for 6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The canonical SMILES for 6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid is COCc1nc2scc(C)n2c1C(=O)O.
What is the InChIKey of 6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The InChIKey is YHNOMVRZVYISQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3S/c1-5-4-15-9-10-6(3-14-2)7(8(12)13)11(5)9/h4H,3H2,1-2H3,(H,12,13).
What are the key properties of 6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid has a molecular weight of 226.26 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methoxymethyl)-3-methylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid is sourced from PubChem (CID 107511744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).