2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole

C12H11F3N2S — CID 21482912

IUPAC2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole
SMILESFC(F)(F)c1cccc(C2CN3CCN=C3S2)c1
InChIInChI=1S/C12H11F3N2S/c13-12(14,15)9-3-1-2-8(6-9)10-7-17-5-4-16-11(17)18-10/h1-3,6,10H,4-5,7H2
InChIKeyLYRSUFRSFDFVHW-UHFFFAOYSA-N
MW272.30 g/mol
LogP3.16
Rot. Bonds1

About 2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole

2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole (PubChem CID 21482912) has the molecular formula C12H11F3N2S and a molecular weight of 272.30 g/mol. Its IUPAC name is 2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole
PubChem CID21482912
Molecular FormulaC12H11F3N2S
Molecular Weight272.30 g/mol
Exact Mass272.06
IUPAC Name2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole
SMILESFC(F)(F)c1cccc(C2CN3CCN=C3S2)c1
InChIInChI=1S/C12H11F3N2S/c13-12(14,15)9-3-1-2-8(6-9)10-7-17-5-4-16-11(17)18-10/h1-3,6,10H,4-5,7H2
InChIKeyLYRSUFRSFDFVHW-UHFFFAOYSA-N
XLogP3.16
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;hydrochloride
CID 159455563
3-[3-(trifluoromethyl)phenyl]-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 98288892
1-methyl-3-[3-(trifluoromethyl)phenyl]pyrrolidine
CID 18722940
1-cyclopropyl-3-(trifluoromethyl)benzene
CID 12509713
1-methyl-4-[3-(trifluoromethyl)phenyl]piperidine
CID 18722963
1-methyl-5-[3-(trifluoromethyl)phenyl]-5,6-dihydro-4H-pyrimidin-2-amine
CID 70506163
1-cyclobutyl-3-(trifluoromethyl)benzene
CID 67441515
1-methyl-4-[3-(trifluoromethyl)phenyl]imidazolidin-2-one
CID 90179148
1-cyclopropyl-3-(trifluoromethyl)benzene;formonitrile
CID 159608211
cyclopropyl-[(2S)-2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]methanone
CID 7364657
1-hydroxy-2-[3-(trifluoromethyl)phenyl]imidazolidine
CID 151676158
[3-(trifluoromethyl)phenyl]-[(2R)-2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]methanone
CID 7398446

Frequently Asked Questions

What is the IUPAC name of 2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole (CID 21482912) is 2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole is FC(F)(F)c1cccc(C2CN3CCN=C3S2)c1.
What is the InChIKey of 2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole?
The InChIKey is LYRSUFRSFDFVHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F3N2S/c13-12(14,15)9-3-1-2-8(6-9)10-7-17-5-4-16-11(17)18-10/h1-3,6,10H,4-5,7H2.
What are the key properties of 2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole?
2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole has a molecular weight of 272.30 g/mol, XLogP of 3.16, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(trifluoromethyl)phenyl]-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 21482912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).