[2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol

C11H12F3N3OS — CID 169086337

IUPAC[2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol
SMILESCC(C)n1cc(C(F)(F)F)nc1-c1ncc(CO)s1
InChIInChI=1S/C11H12F3N3OS/c1-6(2)17-4-8(11(12,13)14)16-9(17)10-15-3-7(5-18)19-10/h3-4,6,18H,5H2,1-2H3
InChIKeyFRAFRNQLTPSLCN-UHFFFAOYSA-N
MW291.30 g/mol
LogP3.10
Rot. Bonds3

About [2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol

[2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol (PubChem CID 169086337) has the molecular formula C11H12F3N3OS and a molecular weight of 291.30 g/mol. Its IUPAC name is [2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol
PubChem CID169086337
Molecular FormulaC11H12F3N3OS
Molecular Weight291.30 g/mol
Exact Mass291.07
IUPAC Name[2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol
SMILESCC(C)n1cc(C(F)(F)F)nc1-c1ncc(CO)s1
InChIInChI=1S/C11H12F3N3OS/c1-6(2)17-4-8(11(12,13)14)16-9(17)10-15-3-7(5-18)19-10/h3-4,6,18H,5H2,1-2H3
InChIKeyFRAFRNQLTPSLCN-UHFFFAOYSA-N
XLogP3.10
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.30
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(5-Fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol
CID 139890376
[6-(Trifluoromethyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanol
CID 139890419
[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]-1,3-thiazol-5-yl]methanol
CID 169086364
2-[1-Propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazole-5-carbaldehyde
CID 169086399
2-Methyl-5-[4-(trifluoromethyl)imidazol-1-yl]-1,3-thiazole
CID 177744496
[6-[Propan-2-yl(2,2,2-trifluoroethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 55010297
[6-[Cyclopropyl(2,2,2-trifluoroethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 55010587
[6-[Ethyl(2,2,2-trifluoroethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 55010630
[6-[Propyl(2,2,2-trifluoroethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 55010828
[6-[Methyl(2,2,2-trifluoroethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 60890629
[6-[4-(2,2,2-Trifluoroethyl)piperazin-1-yl]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 62966837
[6-[Methyl(3,3,3-trifluoropropyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 65539199

Frequently Asked Questions

What is the IUPAC name of [2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol (CID 169086337) is [2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol is CC(C)n1cc(C(F)(F)F)nc1-c1ncc(CO)s1.
What is the InChIKey of [2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol?
The InChIKey is FRAFRNQLTPSLCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3N3OS/c1-6(2)17-4-8(11(12,13)14)16-9(17)10-15-3-7(5-18)19-10/h3-4,6,18H,5H2,1-2H3.
What are the key properties of [2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol?
[2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol has a molecular weight of 291.30 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[1-propan-2-yl-4-(trifluoromethyl)imidazol-2-yl]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 169086337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).