3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride

C8H13ClN2S — CID 3059696

IUPAC3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride
SMILESCC1=CSC2=NC(C)(C)CN12.Cl
InChIInChI=1S/C8H12N2S.ClH/c1-6-4-11-7-9-8(2,3)5-10(6)7;/h4H,5H2,1-3H3;1H
InChIKeyILNOTYJKJNHHQQ-UHFFFAOYSA-N
MW204.73 g/mol
LogP2.47
Rot. Bonds

About 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride

3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride (PubChem CID 3059696) has the molecular formula C8H13ClN2S and a molecular weight of 204.73 g/mol. Its IUPAC name is 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride.

Molecular Properties

Compound Name3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride
PubChem CID3059696
Molecular FormulaC8H13ClN2S
Molecular Weight204.73 g/mol
Exact Mass204.05
IUPAC Name3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride
SMILESCC1=CSC2=NC(C)(C)CN12.Cl
InChIInChI=1S/C8H12N2S.ClH/c1-6-4-11-7-9-8(2,3)5-10(6)7;/h4H,5H2,1-3H3;1H
InChIKeyILNOTYJKJNHHQQ-UHFFFAOYSA-N
XLogP2.47
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.73
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride?
The IUPAC name of 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride (CID 3059696) is 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride.
What is the SMILES notation for 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride?
The canonical SMILES for 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride is CC1=CSC2=NC(C)(C)CN12.Cl.
What is the InChIKey of 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride?
The InChIKey is ILNOTYJKJNHHQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2S.ClH/c1-6-4-11-7-9-8(2,3)5-10(6)7;/h4H,5H2,1-3H3;1H.
What are the key properties of 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride?
3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride has a molecular weight of 204.73 g/mol, XLogP of 2.47, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole;hydrochloride is sourced from PubChem (CID 3059696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).