2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol

C12H14N2OS — CID 117136074

IUPAC2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol
SMILESOc1cccn2cc(CC3CCSC3)nc12
InChIInChI=1S/C12H14N2OS/c15-11-2-1-4-14-7-10(13-12(11)14)6-9-3-5-16-8-9/h1-2,4,7,9,15H,3,5-6,8H2
InChIKeyJWRBINZMRBOJBM-UHFFFAOYSA-N
MW234.32 g/mol
LogP2.34
Rot. Bonds2

About 2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol

2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol (PubChem CID 117136074) has the molecular formula C12H14N2OS and a molecular weight of 234.32 g/mol. Its IUPAC name is 2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol.

Molecular Properties

Compound Name2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol
PubChem CID117136074
Molecular FormulaC12H14N2OS
Molecular Weight234.32 g/mol
Exact Mass234.08
IUPAC Name2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol
SMILESOc1cccn2cc(CC3CCSC3)nc12
InChIInChI=1S/C12H14N2OS/c15-11-2-1-4-14-7-10(13-12(11)14)6-9-3-5-16-8-9/h1-2,4,7,9,15H,3,5-6,8H2
InChIKeyJWRBINZMRBOJBM-UHFFFAOYSA-N
XLogP2.34
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-methyl-2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117136072
8-bromo-2-(thian-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117136980
8-methyl-2-(thian-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117136976
2-[(1-ethylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-8-ol
CID 117136102
6-chloro-2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117129093
2-(oxan-2-ylmethyl)imidazo[1,2-a]pyridin-8-ol
CID 117136833
[2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-6-yl]methanamine
CID 117129046
2-(thian-4-ylmethyl)imidazo[1,2-a]pyridin-6-ol
CID 117129235
3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-8-ol
CID 117146330
8-methyl-2-[(1-methylpiperidin-4-yl)methyl]imidazo[1,2-a]pyridine
CID 117136212
8-chloro-2-(oxan-4-ylmethyl)imidazo[1,2-a]pyridine
CID 117136187
8-fluoro-2-(piperidin-4-ylmethyl)imidazo[1,2-a]pyridine
CID 105492803

Frequently Asked Questions

What is the IUPAC name of 2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol?
The IUPAC name of 2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol (CID 117136074) is 2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol.
What is the SMILES notation for 2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol?
The canonical SMILES for 2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol is Oc1cccn2cc(CC3CCSC3)nc12.
What is the InChIKey of 2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol?
The InChIKey is JWRBINZMRBOJBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS/c15-11-2-1-4-14-7-10(13-12(11)14)6-9-3-5-16-8-9/h1-2,4,7,9,15H,3,5-6,8H2.
What are the key properties of 2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol?
2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol has a molecular weight of 234.32 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridin-8-ol is sourced from PubChem (CID 117136074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).