2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride

C8H9ClN2O2S — CID 67405889

IUPAC2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride
SMILESCc1cn2cc(CC(=O)O)nc2s1.Cl
InChIInChI=1S/C8H8N2O2S.ClH/c1-5-3-10-4-6(2-7(11)12)9-8(10)13-5;/h3-4H,2H2,1H3,(H,11,12);1H
InChIKeyJNAUGIZQMKDWJE-UHFFFAOYSA-N
MW232.69 g/mol
LogP1.75
Rot. Bonds2

About 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride

2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride (PubChem CID 67405889) has the molecular formula C8H9ClN2O2S and a molecular weight of 232.69 g/mol. Its IUPAC name is 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride.

Molecular Properties

Compound Name2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride
PubChem CID67405889
Molecular FormulaC8H9ClN2O2S
Molecular Weight232.69 g/mol
Exact Mass232.01
IUPAC Name2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride
SMILESCc1cn2cc(CC(=O)O)nc2s1.Cl
InChIInChI=1S/C8H8N2O2S.ClH/c1-5-3-10-4-6(2-7(11)12)9-8(10)13-5;/h3-4H,2H2,1H3,(H,11,12);1H
InChIKeyJNAUGIZQMKDWJE-UHFFFAOYSA-N
XLogP1.75
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.69
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Ethyl 2-(imidazo(2,1-b)(1,3)thiazol-6-yl)acetate
CID 853574
2-(Imidazo(2,1-b)(1,3)thiazol-6-yl)acetic acid
CID 3157493
2-(6-Methylimidazo(2,1-b)(1,3)thiazol-3-yl)acetic acid
CID 12461970
2-(3-Methylimidazo(2,1-b)(1,3)thiazol-6-yl)acetic acid
CID 12312080
2-(2-Methylimidazo(2,1-b)(1,3)thiazol-6-yl)acetic acid
CID 39197653
2-{Imidazo[2,1-b][1,3]thiazol-3-yl}acetic acid
CID 43612195
2-{Imidazo[4,3-b][1,3]thiazol-3-yl}acetic acid
CID 82407890
3-(6-Methylimidazo[2,1-b]thiazol-3-yl)propanoic acid
CID 52904010
(2Z)-imidazo[2,1-b][1,3]thiazol-6-yl(methoxyimino)ethanoic acid
CID 6374361
2-Imidazo[2,1-b][1,3]thiazol-5-ylacetic acid
CID 82407893
2-[6-(Trifluoromethyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetic acid
CID 43535920
Ethyl 2-[6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetate
CID 43535921

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride?
The IUPAC name of 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride (CID 67405889) is 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride.
What is the SMILES notation for 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride?
The canonical SMILES for 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride is Cc1cn2cc(CC(=O)O)nc2s1.Cl.
What is the InChIKey of 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride?
The InChIKey is JNAUGIZQMKDWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2S.ClH/c1-5-3-10-4-6(2-7(11)12)9-8(10)13-5;/h3-4H,2H2,1H3,(H,11,12);1H.
What are the key properties of 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride?
2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride has a molecular weight of 232.69 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)acetic acid;hydrochloride is sourced from PubChem (CID 67405889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).