8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine

C10H12N2S — CID 163440455

IUPAC8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine
SMILESCSCCc1cccn2cncc12
InChIInChI=1S/C10H12N2S/c1-13-6-4-9-3-2-5-12-8-11-7-10(9)12/h2-3,5,7-8H,4,6H2,1H3
InChIKeyAYCGIZJHUMDNDJ-UHFFFAOYSA-N
MW192.29 g/mol
LogP2.24
Rot. Bonds3

About 8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine

8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine (PubChem CID 163440455) has the molecular formula C10H12N2S and a molecular weight of 192.29 g/mol. Its IUPAC name is 8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine.

Molecular Properties

Compound Name8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine
PubChem CID163440455
Molecular FormulaC10H12N2S
Molecular Weight192.29 g/mol
Exact Mass192.07
IUPAC Name8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine
SMILESCSCCc1cccn2cncc12
InChIInChI=1S/C10H12N2S/c1-13-6-4-9-3-2-5-12-8-11-7-10(9)12/h2-3,5,7-8H,4,6H2,1H3
InChIKeyAYCGIZJHUMDNDJ-UHFFFAOYSA-N
XLogP2.24
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.29
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine?
The IUPAC name of 8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine (CID 163440455) is 8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine.
What is the SMILES notation for 8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine?
The canonical SMILES for 8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine is CSCCc1cccn2cncc12.
What is the InChIKey of 8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine?
The InChIKey is AYCGIZJHUMDNDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2S/c1-13-6-4-9-3-2-5-12-8-11-7-10(9)12/h2-3,5,7-8H,4,6H2,1H3.
What are the key properties of 8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine?
8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine has a molecular weight of 192.29 g/mol, XLogP of 2.24, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-methylsulfanylethyl)imidazo[1,5-a]pyridine is sourced from PubChem (CID 163440455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).