3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid

C11H7N3O2S — CID 82062120

IUPAC3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESO=C(O)c1cnc2scc(-c3cccnc3)n12
InChIInChI=1S/C11H7N3O2S/c15-10(16)8-5-13-11-14(8)9(6-17-11)7-2-1-3-12-4-7/h1-6H,(H,15,16)
InChIKeyJJHFWARFQJDTJA-UHFFFAOYSA-N
MW245.26 g/mol
LogP2.16
Rot. Bonds2

About 3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid

3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid (PubChem CID 82062120) has the molecular formula C11H7N3O2S and a molecular weight of 245.26 g/mol. Its IUPAC name is 3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid.

Molecular Properties

Compound Name3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
PubChem CID82062120
Molecular FormulaC11H7N3O2S
Molecular Weight245.26 g/mol
Exact Mass245.03
IUPAC Name3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
SMILESO=C(O)c1cnc2scc(-c3cccnc3)n12
InChIInChI=1S/C11H7N3O2S/c15-10(16)8-5-13-11-14(8)9(6-17-11)7-2-1-3-12-4-7/h1-6H,(H,15,16)
InChIKeyJJHFWARFQJDTJA-UHFFFAOYSA-N
XLogP2.16
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 82061917
3-(4-propoxyphenyl)imidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 82062009
7-amino-3-pyridin-3-yl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 139236707
3-bromoimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 118704521
2-(3-phenylimidazo[2,1-b][1,3]thiazol-5-yl)acetic acid
CID 82062239
5-bromo-3-phenylimidazo[2,1-b][1,3]thiazole
CID 165493348
(3-phenylimidazo[2,1-b][1,3]thiazol-5-yl)methanol
CID 82061842
2-[6-(furan-2-yl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 82062379
6-(4-methylphenyl)-3-pyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-amine
CID 93216195
2-amino-4-pyridin-3-ylthiophene-3-carboxylic acid
CID 70232661
3-(4-phenylphenyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 39199056
2-(3,6-dipyridin-3-ylimidazo[2,1-b][1,3]thiazol-5-yl)acetonitrile
CID 93210732

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The IUPAC name of 3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid (CID 82062120) is 3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid.
What is the SMILES notation for 3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The canonical SMILES for 3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid is O=C(O)c1cnc2scc(-c3cccnc3)n12.
What is the InChIKey of 3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
The InChIKey is JJHFWARFQJDTJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7N3O2S/c15-10(16)8-5-13-11-14(8)9(6-17-11)7-2-1-3-12-4-7/h1-6H,(H,15,16).
What are the key properties of 3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid?
3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid has a molecular weight of 245.26 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-3-ylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid is sourced from PubChem (CID 82062120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).