tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane

C12H19FN2OSSi — CID 139890415

IUPACtert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1nc2sccn2c1F
InChIInChI=1S/C12H19FN2OSSi/c1-12(2,3)18(4,5)16-8-9-10(13)15-6-7-17-11(15)14-9/h6-7H,8H2,1-5H3
InChIKeyOOLXKCACINBQRR-UHFFFAOYSA-N
MW286.45 g/mol
LogP4.06
Rot. Bonds3

About tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane

tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane (PubChem CID 139890415) has the molecular formula C12H19FN2OSSi and a molecular weight of 286.45 g/mol. Its IUPAC name is tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane
PubChem CID139890415
Molecular FormulaC12H19FN2OSSi
Molecular Weight286.45 g/mol
Exact Mass286.10
IUPAC Nametert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1nc2sccn2c1F
InChIInChI=1S/C12H19FN2OSSi/c1-12(2,3)18(4,5)16-8-9-10(13)15-6-7-17-11(15)14-9/h6-7H,8H2,1-5H3
InChIKeyOOLXKCACINBQRR-UHFFFAOYSA-N
XLogP4.06
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.45
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Imidazo[2,1-b]thiazol-6-ylmethanol
CID 4961267
{6-Methylimidazo[2,1-b][1,3]thiazol-5-yl}methanol
CID 332985
(5-Fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methanol
CID 139890345
Tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methoxy]-dimethylsilane
CID 139890379
[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-[Methyl(3,3,3-trifluoropropyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 65539199
2-[2,2-Difluoroethyl-[5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-6-yl]amino]ethanol
CID 107481009
2-[[5-(Hydroxymethyl)imidazo[2,1-b][1,3]thiazol-6-yl]-(2,2,2-trifluoroethyl)amino]ethanol
CID 107481078

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane (CID 139890415) is tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OCc1nc2sccn2c1F.
What is the InChIKey of tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane?
The InChIKey is OOLXKCACINBQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19FN2OSSi/c1-12(2,3)18(4,5)16-8-9-10(13)15-6-7-17-11(15)14-9/h6-7H,8H2,1-5H3.
What are the key properties of tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane?
tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane has a molecular weight of 286.45 g/mol, XLogP of 4.06, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(5-fluoroimidazo[2,1-b][1,3]thiazol-6-yl)methoxy]-dimethylsilane is sourced from PubChem (CID 139890415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).