8-chloro-1-methylimidazo[1,5-a]pyridine;ethane

C10H13ClN2 — CID 167522541

IUPAC8-chloro-1-methylimidazo[1,5-a]pyridine;ethane
SMILESCC.Cc1ncn2cccc(Cl)c12
InChIInChI=1S/C8H7ClN2.C2H6/c1-6-8-7(9)3-2-4-11(8)5-10-6;1-2/h2-5H,1H3;1-2H3
InChIKeyOGPYXPLDBVLUME-UHFFFAOYSA-N
MW196.68 g/mol
LogP3.32
Rot. Bonds

About 8-chloro-1-methylimidazo[1,5-a]pyridine;ethane

8-chloro-1-methylimidazo[1,5-a]pyridine;ethane (PubChem CID 167522541) has the molecular formula C10H13ClN2 and a molecular weight of 196.68 g/mol. Its IUPAC name is 8-chloro-1-methylimidazo[1,5-a]pyridine;ethane.

Molecular Properties

Compound Name8-chloro-1-methylimidazo[1,5-a]pyridine;ethane
PubChem CID167522541
Molecular FormulaC10H13ClN2
Molecular Weight196.68 g/mol
Exact Mass196.08
IUPAC Name8-chloro-1-methylimidazo[1,5-a]pyridine;ethane
SMILESCC.Cc1ncn2cccc(Cl)c12
InChIInChI=1S/C8H7ClN2.C2H6/c1-6-8-7(9)3-2-4-11(8)5-10-6;1-2/h2-5H,1H3;1-2H3
InChIKeyOGPYXPLDBVLUME-UHFFFAOYSA-N
XLogP3.32
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.68
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-1-methylimidazo[1,5-a]pyridine;ethane?
The IUPAC name of 8-chloro-1-methylimidazo[1,5-a]pyridine;ethane (CID 167522541) is 8-chloro-1-methylimidazo[1,5-a]pyridine;ethane.
What is the SMILES notation for 8-chloro-1-methylimidazo[1,5-a]pyridine;ethane?
The canonical SMILES for 8-chloro-1-methylimidazo[1,5-a]pyridine;ethane is CC.Cc1ncn2cccc(Cl)c12.
What is the InChIKey of 8-chloro-1-methylimidazo[1,5-a]pyridine;ethane?
The InChIKey is OGPYXPLDBVLUME-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN2.C2H6/c1-6-8-7(9)3-2-4-11(8)5-10-6;1-2/h2-5H,1H3;1-2H3.
What are the key properties of 8-chloro-1-methylimidazo[1,5-a]pyridine;ethane?
8-chloro-1-methylimidazo[1,5-a]pyridine;ethane has a molecular weight of 196.68 g/mol, XLogP of 3.32, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-1-methylimidazo[1,5-a]pyridine;ethane is sourced from PubChem (CID 167522541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).