(3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol

C10H14N2OS — CID 82062061

IUPAC(3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol
SMILESCC(C)(C)c1csc2ncc(CO)n12
InChIInChI=1S/C10H14N2OS/c1-10(2,3)8-6-14-9-11-4-7(5-13)12(8)9/h4,6,13H,5H2,1-3H3
InChIKeyPMCJVPYHNWILLL-UHFFFAOYSA-N
MW210.30 g/mol
LogP2.19
Rot. Bonds1

About (3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol

(3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol (PubChem CID 82062061) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is (3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol.

Molecular Properties

Compound Name(3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol
PubChem CID82062061
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC Name(3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol
SMILESCC(C)(C)c1csc2ncc(CO)n12
InChIInChI=1S/C10H14N2OS/c1-10(2,3)8-6-14-9-11-4-7(5-13)12(8)9/h4,6,13H,5H2,1-3H3
InChIKeyPMCJVPYHNWILLL-UHFFFAOYSA-N
XLogP2.19
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol?
The IUPAC name of (3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol (CID 82062061) is (3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol.
What is the SMILES notation for (3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol?
The canonical SMILES for (3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol is CC(C)(C)c1csc2ncc(CO)n12.
What is the InChIKey of (3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol?
The InChIKey is PMCJVPYHNWILLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c1-10(2,3)8-6-14-9-11-4-7(5-13)12(8)9/h4,6,13H,5H2,1-3H3.
What are the key properties of (3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol?
(3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol has a molecular weight of 210.30 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-tert-butylimidazo[2,1-b][1,3]thiazol-5-yl)methanol is sourced from PubChem (CID 82062061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).