2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol

C12H14N2OS — CID 117136589

IUPAC2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol
SMILESOc1cccn2cc(C3CCCCS3)nc12
InChIInChI=1S/C12H14N2OS/c15-10-4-3-6-14-8-9(13-12(10)14)11-5-1-2-7-16-11/h3-4,6,8,11,15H,1-2,5,7H2
InChIKeyCRFFJHMVAFVPGE-UHFFFAOYSA-N
MW234.32 g/mol
LogP3.00
Rot. Bonds1

About 2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol

2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol (PubChem CID 117136589) has the molecular formula C12H14N2OS and a molecular weight of 234.32 g/mol. Its IUPAC name is 2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol.

Molecular Properties

Compound Name2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol
PubChem CID117136589
Molecular FormulaC12H14N2OS
Molecular Weight234.32 g/mol
Exact Mass234.08
IUPAC Name2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol
SMILESOc1cccn2cc(C3CCCCS3)nc12
InChIInChI=1S/C12H14N2OS/c15-10-4-3-6-14-8-9(13-12(10)14)11-5-1-2-7-16-11/h3-4,6,8,11,15H,1-2,5,7H2
InChIKeyCRFFJHMVAFVPGE-UHFFFAOYSA-N
XLogP3.00
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopentylimidazo[1,2-a]pyridin-8-ol
CID 117137747
8-methyl-2-(thiolan-2-yl)imidazo[1,2-a]pyridine
CID 117136459
2-cyclopropylimidazo[1,2-a]pyridin-8-ol
CID 117137728
7-methyl-2-(thian-2-yl)imidazo[1,2-a]pyridine
CID 117134294
2-(1-ethylpyrrolidin-2-yl)imidazo[1,2-a]pyridin-8-ol
CID 117136486
2-(thian-2-yl)imidazo[1,2-a]pyridine-7-carbaldehyde
CID 117134266
2-cyclobutyl-8-methylimidazo[1,2-a]pyridine
CID 117137735
8-methyl-2-(thian-4-yl)imidazo[1,2-a]pyridine
CID 117135947
2-(oxan-2-ylmethyl)imidazo[1,2-a]pyridin-8-ol
CID 117136833
2-(thian-2-yl)imidazo[1,2-a]pyridine-5-carboxylic acid
CID 117131964
8-bromo-2-cyclopropylimidazo[1,2-a]pyridine
CID 79016015
2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol
CID 117136074

Frequently Asked Questions

What is the IUPAC name of 2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol?
The IUPAC name of 2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol (CID 117136589) is 2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol.
What is the SMILES notation for 2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol?
The canonical SMILES for 2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol is Oc1cccn2cc(C3CCCCS3)nc12.
What is the InChIKey of 2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol?
The InChIKey is CRFFJHMVAFVPGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS/c15-10-4-3-6-14-8-9(13-12(10)14)11-5-1-2-7-16-11/h3-4,6,8,11,15H,1-2,5,7H2.
What are the key properties of 2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol?
2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol has a molecular weight of 234.32 g/mol, XLogP of 3.00, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thian-2-yl)imidazo[1,2-a]pyridin-8-ol is sourced from PubChem (CID 117136589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).