6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde

C7H3F3N2OS — CID 3760850

IUPAC6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
SMILESO=Cc1c(C(F)(F)F)nc2sccn12
InChIInChI=1S/C7H3F3N2OS/c8-7(9,10)5-4(3-13)12-1-2-14-6(12)11-5/h1-3H
InChIKeyUZNYVYBQRNSEGZ-UHFFFAOYSA-N
MW220.18 g/mol
LogP2.23
Rot. Bonds1

About 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde

6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde (PubChem CID 3760850) has the molecular formula C7H3F3N2OS and a molecular weight of 220.18 g/mol. Its IUPAC name is 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde.

Molecular Properties

Compound Name6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
PubChem CID3760850
Molecular FormulaC7H3F3N2OS
Molecular Weight220.18 g/mol
Exact Mass219.99
IUPAC Name6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
SMILESO=Cc1c(C(F)(F)F)nc2sccn12
InChIInChI=1S/C7H3F3N2OS/c8-7(9,10)5-4(3-13)12-1-2-14-6(12)11-5/h1-3H
InChIKeyUZNYVYBQRNSEGZ-UHFFFAOYSA-N
XLogP2.23
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.18
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

6-Methylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 329947
Imidazo(2,1-b)(1,3)thiazole-2-carbaldehyde
CID 73553580
6-Chloroimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 329950
6-(Isopropylthio)imidazo[2,1-b]thiazole-5-carbaldehyde
CID 1180480
Imidazo(2,1-b)(1,3)thiazole-6-carbaldehyde
CID 4961258
2,6-Dimethylimidazo(2,1-b)(1,3)thiazole-5-carbaldehyde
CID 9115270
2-((5-Formylimidazo[2,1-b]thiazol-6-yl)thio)acetic acid
CID 16641932
3-Methylimidazo(2,1-b)(1,3)thiazole-5-carbaldehyde
CID 21256490
Imidazo(4,3-b)(1,3)thiazole-7-carbaldehyde
CID 22390357
2-Methylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 39198291
2-Methylimidazo(4,3-b)(1,3)thiazole-3-carbaldehyde
CID 137500092
2,2,2-Trifluoro-1-{6-methylimidazo[2,1-b][1,3]thiazol-5-yl}ethan-1-one
CID 4008219

Frequently Asked Questions

What is the IUPAC name of 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
The IUPAC name of 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde (CID 3760850) is 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde.
What is the SMILES notation for 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
The canonical SMILES for 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde is O=Cc1c(C(F)(F)F)nc2sccn12.
What is the InChIKey of 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
The InChIKey is UZNYVYBQRNSEGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H3F3N2OS/c8-7(9,10)5-4(3-13)12-1-2-14-6(12)11-5/h1-3H.
What are the key properties of 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde?
6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde has a molecular weight of 220.18 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(trifluoromethyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde is sourced from PubChem (CID 3760850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).