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1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone

C9H7ClN2O — CID 154727621

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone
SMILESCC(=O)c1cc(Cl)cn2cncc12
InChIInChI=1S/C9H7ClN2O/c1-6(13)8-2-7(10)4-12-5-11-3-9(8)12/h2-5H,1H3
InChIKeyMMKLAKKMKJFWKB-UHFFFAOYSA-N
MW194.62 g/mol
LogP2.19
Rot. Bonds1

About 1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone

1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone (PubChem CID 154727621) has the molecular formula C9H7ClN2O and a molecular weight of 194.62 g/mol. Its IUPAC name is 1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone.

Molecular Properties

Compound Name1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone
PubChem CID154727621
Molecular FormulaC9H7ClN2O
Molecular Weight194.62 g/mol
Exact Mass194.02
IUPAC Name1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone
SMILESCC(=O)c1cc(Cl)cn2cncc12
InChIInChI=1S/C9H7ClN2O/c1-6(13)8-2-7(10)4-12-5-11-3-9(8)12/h2-5H,1H3
InChIKeyMMKLAKKMKJFWKB-UHFFFAOYSA-N
XLogP2.19
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.62
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone?
The IUPAC name of 1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone (CID 154727621) is 1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone.
What is the SMILES notation for 1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone?
The canonical SMILES for 1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone is CC(=O)c1cc(Cl)cn2cncc12.
What is the InChIKey of 1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone?
The InChIKey is MMKLAKKMKJFWKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2O/c1-6(13)8-2-7(10)4-12-5-11-3-9(8)12/h2-5H,1H3.
What are the key properties of 1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone?
1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone has a molecular weight of 194.62 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloroimidazo[1,5-a]pyridin-8-yl)ethanone is sourced from PubChem (CID 154727621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

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