2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid

C7H6N2O2S — CID 28950220

IUPAC2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid
SMILESCc1cn2cc(C(=O)O)nc2s1
InChIInChI=1S/C7H6N2O2S/c1-4-2-9-3-5(6(10)11)8-7(9)12-4/h2-3H,1H3,(H,10,11)
InChIKeyNEIIRHYEZKVAKX-UHFFFAOYSA-N
MW182.20 g/mol
LogP1.40
Rot. Bonds1

About 2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid

2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid (PubChem CID 28950220) has the molecular formula C7H6N2O2S and a molecular weight of 182.20 g/mol. Its IUPAC name is 2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid.

Molecular Properties

Compound Name2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid
PubChem CID28950220
Molecular FormulaC7H6N2O2S
Molecular Weight182.20 g/mol
Exact Mass182.01
IUPAC Name2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid
SMILESCc1cn2cc(C(=O)O)nc2s1
InChIInChI=1S/C7H6N2O2S/c1-4-2-9-3-5(6(10)11)8-7(9)12-4/h2-3H,1H3,(H,10,11)
InChIKeyNEIIRHYEZKVAKX-UHFFFAOYSA-N
XLogP1.40
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.20
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-Chloroimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 329977
6-Methylimidazo[2,1-B][1,3]thiazole-5-carboxylic acid
CID 329979
5-Methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid
CID 45791447
Imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
CID 2759354
2,6-Dimethylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 39197681
Imidazo(2,1-b)(1,3)thiazole-2-carboxylic acid
CID 45088965
Imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 52983818
Ethyl 2-bromoimidazo(2,1-b)(1,3)thiazole-6-carboxylate
CID 12744614
3-Methylimidazo(2,1-b)(1,3)thiazole-5-carboxylic acid
CID 21256471
2,3-Dimethylimidazo(2,1-b)(1,3)thiazole-5-carboxylic acid
CID 21256477
Imidazo(2,1-b)(1,3)thiazole-3-carboxylic acid
CID 22750131
2-Methylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 39198291

Frequently Asked Questions

What is the IUPAC name of 2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid?
The IUPAC name of 2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid (CID 28950220) is 2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid.
What is the SMILES notation for 2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid?
The canonical SMILES for 2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid is Cc1cn2cc(C(=O)O)nc2s1.
What is the InChIKey of 2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid?
The InChIKey is NEIIRHYEZKVAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O2S/c1-4-2-9-3-5(6(10)11)8-7(9)12-4/h2-3H,1H3,(H,10,11).
What are the key properties of 2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid?
2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid has a molecular weight of 182.20 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid is sourced from PubChem (CID 28950220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).