3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole

C11H18N2S — CID 58919242

IUPAC3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole
SMILESCC1(C)CN2C(C(C)(C)C)=CSC2=N1
InChIInChI=1S/C11H18N2S/c1-10(2,3)8-6-14-9-12-11(4,5)7-13(8)9/h6H,7H2,1-5H3
InChIKeyHRMVZNYDORCJBD-UHFFFAOYSA-N
MW210.35 g/mol
LogP3.07
Rot. Bonds

About 3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole

3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole (PubChem CID 58919242) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole
PubChem CID58919242
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole
SMILESCC1(C)CN2C(C(C)(C)C)=CSC2=N1
InChIInChI=1S/C11H18N2S/c1-10(2,3)8-6-14-9-12-11(4,5)7-13(8)9/h6H,7H2,1-5H3
InChIKeyHRMVZNYDORCJBD-UHFFFAOYSA-N
XLogP3.07
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole?
The IUPAC name of 3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole (CID 58919242) is 3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole is CC1(C)CN2C(C(C)(C)C)=CSC2=N1.
What is the InChIKey of 3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole?
The InChIKey is HRMVZNYDORCJBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-10(2,3)8-6-14-9-12-11(4,5)7-13(8)9/h6H,7H2,1-5H3.
What are the key properties of 3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole?
3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole has a molecular weight of 210.35 g/mol, XLogP of 3.07, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-6,6-dimethyl-5H-imidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 58919242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).