8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine

C13H16N2S — CID 117136718

IUPAC8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine
SMILESCc1cccn2cc(CC3CCCS3)nc12
InChIInChI=1S/C13H16N2S/c1-10-4-2-6-15-9-11(14-13(10)15)8-12-5-3-7-16-12/h2,4,6,9,12H,3,5,7-8H2,1H3
InChIKeyFYSNBPQPSZYXIX-UHFFFAOYSA-N
MW232.35 g/mol
LogP3.08
Rot. Bonds2

About 8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine

8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine (PubChem CID 117136718) has the molecular formula C13H16N2S and a molecular weight of 232.35 g/mol. Its IUPAC name is 8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine
PubChem CID117136718
Molecular FormulaC13H16N2S
Molecular Weight232.35 g/mol
Exact Mass232.10
IUPAC Name8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine
SMILESCc1cccn2cc(CC3CCCS3)nc12
InChIInChI=1S/C13H16N2S/c1-10-4-2-6-15-9-11(14-13(10)15)8-12-5-3-7-16-12/h2,4,6,9,12H,3,5,7-8H2,1H3
InChIKeyFYSNBPQPSZYXIX-UHFFFAOYSA-N
XLogP3.08
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

8-methyl-2-(thian-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117136976
8-methyl-2-(thiolan-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117136072
8-methyl-2-(thiolan-2-yl)imidazo[1,2-a]pyridine
CID 117136459
8-methyl-2-[(1-methylpiperidin-4-yl)methyl]imidazo[1,2-a]pyridine
CID 117136212
8-methyl-2-(oxan-2-ylmethyl)imidazo[1,2-a]pyridine
CID 117136831
8-methyl-2-(thian-2-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117136854
8-methyl-2-(pyrrolidin-1-ylmethyl)imidazo[1,2-a]pyridine
CID 4702012
(8-methylimidazo[1,2-a]pyridin-2-yl)methanamine;dihydrochloride
CID 50988319
N-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]cyclohexanecarboxamide
CID 3244515
N,N-dimethyl-1-(8-methylimidazo[1,2-a]pyridin-2-yl)methanamine
CID 70660652
1-[(2R)-2-[(2R)-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]pyrrolidin-1-yl]ethanone
CID 98761952
[3-methyl-1-[(8-methylimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]methanol
CID 102788132

Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine (CID 117136718) is 8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine is Cc1cccn2cc(CC3CCCS3)nc12.
What is the InChIKey of 8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine?
The InChIKey is FYSNBPQPSZYXIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2S/c1-10-4-2-6-15-9-11(14-13(10)15)8-12-5-3-7-16-12/h2,4,6,9,12H,3,5,7-8H2,1H3.
What are the key properties of 8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine?
8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine has a molecular weight of 232.35 g/mol, XLogP of 3.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-(thiolan-2-ylmethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 117136718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).