2-imidazo[5,1-b][1,3]thiazol-3-ylethanol

C7H8N2OS — CID 19605055

IUPAC2-imidazo[5,1-b][1,3]thiazol-3-ylethanol
SMILESOCCc1csc2cncn12
InChIInChI=1S/C7H8N2OS/c10-2-1-6-4-11-7-3-8-5-9(6)7/h3-5,10H,1-2H2
InChIKeyOSQUSJHMCLIDTP-UHFFFAOYSA-N
MW168.22 g/mol
LogP0.93
Rot. Bonds2

About 2-imidazo[5,1-b][1,3]thiazol-3-ylethanol

2-imidazo[5,1-b][1,3]thiazol-3-ylethanol (PubChem CID 19605055) has the molecular formula C7H8N2OS and a molecular weight of 168.22 g/mol. Its IUPAC name is 2-imidazo[5,1-b][1,3]thiazol-3-ylethanol.

Molecular Properties

Compound Name2-imidazo[5,1-b][1,3]thiazol-3-ylethanol
PubChem CID19605055
Molecular FormulaC7H8N2OS
Molecular Weight168.22 g/mol
Exact Mass168.04
IUPAC Name2-imidazo[5,1-b][1,3]thiazol-3-ylethanol
SMILESOCCc1csc2cncn12
InChIInChI=1S/C7H8N2OS/c10-2-1-6-4-11-7-3-8-5-9(6)7/h3-5,10H,1-2H2
InChIKeyOSQUSJHMCLIDTP-UHFFFAOYSA-N
XLogP0.93
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.22
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-imidazo[5,1-b][1,3]thiazol-3-ylethanol?
The IUPAC name of 2-imidazo[5,1-b][1,3]thiazol-3-ylethanol (CID 19605055) is 2-imidazo[5,1-b][1,3]thiazol-3-ylethanol.
What is the SMILES notation for 2-imidazo[5,1-b][1,3]thiazol-3-ylethanol?
The canonical SMILES for 2-imidazo[5,1-b][1,3]thiazol-3-ylethanol is OCCc1csc2cncn12.
What is the InChIKey of 2-imidazo[5,1-b][1,3]thiazol-3-ylethanol?
The InChIKey is OSQUSJHMCLIDTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2OS/c10-2-1-6-4-11-7-3-8-5-9(6)7/h3-5,10H,1-2H2.
What are the key properties of 2-imidazo[5,1-b][1,3]thiazol-3-ylethanol?
2-imidazo[5,1-b][1,3]thiazol-3-ylethanol has a molecular weight of 168.22 g/mol, XLogP of 0.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[5,1-b][1,3]thiazol-3-ylethanol is sourced from PubChem (CID 19605055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).