imidazo[2,1-b][1,3]thiazol-3-ylmethanol

C6H6N2OS — CID 14801956

IUPACimidazo[2,1-b][1,3]thiazol-3-ylmethanol
SMILESOCc1csc2nccn12
InChIInChI=1S/C6H6N2OS/c9-3-5-4-10-6-7-1-2-8(5)6/h1-2,4,9H,3H2
InChIKeyIXQSVSCHTYUAHO-UHFFFAOYSA-N
MW154.19 g/mol
LogP0.89
Rot. Bonds1

About imidazo[2,1-b][1,3]thiazol-3-ylmethanol

imidazo[2,1-b][1,3]thiazol-3-ylmethanol (PubChem CID 14801956) has the molecular formula C6H6N2OS and a molecular weight of 154.19 g/mol. Its IUPAC name is imidazo[2,1-b][1,3]thiazol-3-ylmethanol.

Molecular Properties

Compound Nameimidazo[2,1-b][1,3]thiazol-3-ylmethanol
PubChem CID14801956
Molecular FormulaC6H6N2OS
Molecular Weight154.19 g/mol
Exact Mass154.02
IUPAC Nameimidazo[2,1-b][1,3]thiazol-3-ylmethanol
SMILESOCc1csc2nccn12
InChIInChI=1S/C6H6N2OS/c9-3-5-4-10-6-7-1-2-8(5)6/h1-2,4,9H,3H2
InChIKeyIXQSVSCHTYUAHO-UHFFFAOYSA-N
XLogP0.89
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.19
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of imidazo[2,1-b][1,3]thiazol-3-ylmethanol?
The IUPAC name of imidazo[2,1-b][1,3]thiazol-3-ylmethanol (CID 14801956) is imidazo[2,1-b][1,3]thiazol-3-ylmethanol.
What is the SMILES notation for imidazo[2,1-b][1,3]thiazol-3-ylmethanol?
The canonical SMILES for imidazo[2,1-b][1,3]thiazol-3-ylmethanol is OCc1csc2nccn12.
What is the InChIKey of imidazo[2,1-b][1,3]thiazol-3-ylmethanol?
The InChIKey is IXQSVSCHTYUAHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N2OS/c9-3-5-4-10-6-7-1-2-8(5)6/h1-2,4,9H,3H2.
What are the key properties of imidazo[2,1-b][1,3]thiazol-3-ylmethanol?
imidazo[2,1-b][1,3]thiazol-3-ylmethanol has a molecular weight of 154.19 g/mol, XLogP of 0.89, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[2,1-b][1,3]thiazol-3-ylmethanol is sourced from PubChem (CID 14801956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).