[2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol

C11H12N2O2S — CID 79333805

IUPAC[2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol
SMILESOCc1c(SC2COC2)nc2ccccn12
InChIInChI=1S/C11H12N2O2S/c14-5-9-11(16-8-6-15-7-8)12-10-3-1-2-4-13(9)10/h1-4,8,14H,5-7H2
InChIKeyILBBMZIPUSWHPB-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.32
Rot. Bonds3

About [2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol

[2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol (PubChem CID 79333805) has the molecular formula C11H12N2O2S and a molecular weight of 236.30 g/mol. Its IUPAC name is [2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol.

Molecular Properties

Compound Name[2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol
PubChem CID79333805
Molecular FormulaC11H12N2O2S
Molecular Weight236.30 g/mol
Exact Mass236.06
IUPAC Name[2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol
SMILESOCc1c(SC2COC2)nc2ccccn12
InChIInChI=1S/C11H12N2O2S/c14-5-9-11(16-8-6-15-7-8)12-10-3-1-2-4-13(9)10/h1-4,8,14H,5-7H2
InChIKeyILBBMZIPUSWHPB-UHFFFAOYSA-N
XLogP1.32
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol?
The IUPAC name of [2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol (CID 79333805) is [2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol.
What is the SMILES notation for [2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol?
The canonical SMILES for [2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol is OCc1c(SC2COC2)nc2ccccn12.
What is the InChIKey of [2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol?
The InChIKey is ILBBMZIPUSWHPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S/c14-5-9-11(16-8-6-15-7-8)12-10-3-1-2-4-13(9)10/h1-4,8,14H,5-7H2.
What are the key properties of [2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol?
[2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol has a molecular weight of 236.30 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(oxetan-3-ylsulfanyl)imidazo[1,2-a]pyridin-3-yl]methanol is sourced from PubChem (CID 79333805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).