3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol

C12H14N2OS — CID 117141367

IUPAC3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol
SMILESOc1cccc2cnc(CC3CCSC3)n12
InChIInChI=1S/C12H14N2OS/c15-12-3-1-2-10-7-13-11(14(10)12)6-9-4-5-16-8-9/h1-3,7,9,15H,4-6,8H2
InChIKeyFGBDTJKVSRFMNR-UHFFFAOYSA-N
MW234.32 g/mol
LogP2.34
Rot. Bonds2

About 3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol

3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol (PubChem CID 117141367) has the molecular formula C12H14N2OS and a molecular weight of 234.32 g/mol. Its IUPAC name is 3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol.

Molecular Properties

Compound Name3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol
PubChem CID117141367
Molecular FormulaC12H14N2OS
Molecular Weight234.32 g/mol
Exact Mass234.08
IUPAC Name3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol
SMILESOc1cccc2cnc(CC3CCSC3)n12
InChIInChI=1S/C12H14N2OS/c15-12-3-1-2-10-7-13-11(14(10)12)6-9-4-5-16-8-9/h1-3,7,9,15H,4-6,8H2
InChIKeyFGBDTJKVSRFMNR-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

3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-8-ol
CID 117146330
3-ethylimidazo[1,5-a]pyridin-5-ol
CID 117142112
3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-7-amine
CID 117143877
3-(2-pyrrolidin-1-ylethyl)imidazo[1,5-a]pyridin-5-ol
CID 117142363
3-(2,2-dimethylpropyl)imidazo[1,5-a]pyridin-5-ol
CID 117142115
3-[2-(4-methylpiperazin-1-yl)ethyl]imidazo[1,5-a]pyridin-5-ol
CID 117142355
3-(thiolan-3-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-5-ol
CID 117149866
3-(thiolan-3-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117148345
3-(thiolan-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117138870
2-[2-(thiolan-3-ylmethyl)imidazo[4,5-b]pyridin-3-yl]phenol
CID 117161394
3-[(3-bromophenyl)methyl]imidazo[1,5-a]pyridin-5-ol
CID 117141950
3-(azetidin-3-ylmethyl)-5-methylimidazo[1,5-a]pyridine
CID 105453792

Frequently Asked Questions

What is the IUPAC name of 3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol?
The IUPAC name of 3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol (CID 117141367) is 3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol.
What is the SMILES notation for 3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol?
The canonical SMILES for 3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol is Oc1cccc2cnc(CC3CCSC3)n12.
What is the InChIKey of 3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol?
The InChIKey is FGBDTJKVSRFMNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2OS/c15-12-3-1-2-10-7-13-11(14(10)12)6-9-4-5-16-8-9/h1-3,7,9,15H,4-6,8H2.
What are the key properties of 3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol?
3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-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 3-(thiolan-3-ylmethyl)imidazo[1,5-a]pyridin-5-ol is sourced from PubChem (CID 117141367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).