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

C6H5FN2OS — CID 139890376

IUPAC(5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol
SMILESOCc1cn2c(F)cnc2s1
InChIInChI=1S/C6H5FN2OS/c7-5-1-8-6-9(5)2-4(3-10)11-6/h1-2,10H,3H2
InChIKeyCPYGKIXUJLIHNU-UHFFFAOYSA-N
MW172.18 g/mol
LogP1.03
Rot. Bonds1

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

(5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol (PubChem CID 139890376) has the molecular formula C6H5FN2OS and a molecular weight of 172.18 g/mol. Its IUPAC name is (5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol.

Molecular Properties

Compound Name(5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol
PubChem CID139890376
Molecular FormulaC6H5FN2OS
Molecular Weight172.18 g/mol
Exact Mass172.01
IUPAC Name(5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol
SMILESOCc1cn2c(F)cnc2s1
InChIInChI=1S/C6H5FN2OS/c7-5-1-8-6-9(5)2-4(3-10)11-6/h1-2,10H,3H2
InChIKeyCPYGKIXUJLIHNU-UHFFFAOYSA-N
XLogP1.03
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.18
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol?
The IUPAC name of (5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol (CID 139890376) is (5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol.
What is the SMILES notation for (5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol?
The canonical SMILES for (5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol is OCc1cn2c(F)cnc2s1.
What is the InChIKey of (5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol?
The InChIKey is CPYGKIXUJLIHNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5FN2OS/c7-5-1-8-6-9(5)2-4(3-10)11-6/h1-2,10H,3H2.
What are the key properties of (5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol?
(5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol has a molecular weight of 172.18 g/mol, XLogP of 1.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoroimidazo[2,1-b][1,3]thiazol-2-yl)methanol is sourced from PubChem (CID 139890376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).