1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone

C9H7ClN2O — CID 83879180

IUPAC1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone
SMILESCC(=O)c1nc(Cl)c2ccccn12
InChIInChI=1S/C9H7ClN2O/c1-6(13)9-11-8(10)7-4-2-3-5-12(7)9/h2-5H,1H3
InChIKeySUSNABFYGGGBTG-UHFFFAOYSA-N
MW194.62 g/mol
LogP2.19
Rot. Bonds1

About 1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone

1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone (PubChem CID 83879180) has the molecular formula C9H7ClN2O and a molecular weight of 194.62 g/mol. Its IUPAC name is 1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone.

Molecular Properties

Compound Name1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone
PubChem CID83879180
Molecular FormulaC9H7ClN2O
Molecular Weight194.62 g/mol
Exact Mass194.02
IUPAC Name1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone
SMILESCC(=O)c1nc(Cl)c2ccccn12
InChIInChI=1S/C9H7ClN2O/c1-6(13)9-11-8(10)7-4-2-3-5-12(7)9/h2-5H,1H3
InChIKeySUSNABFYGGGBTG-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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Related Compounds

1-[1-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]ethanone
CID 82391274
1-chloro-N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]imidazo[1,5-a]pyridine-3-carboxamide
CID 70943936
1-chloro-N-(4,4-difluorocyclohexyl)imidazo[1,5-a]pyridine-3-carboxamide
CID 70943935
2-(1-chloroimidazo[1,5-a]pyridin-3-yl)phenol
CID 137005599
1-chloro-7-methylimidazo[1,5-a]pyridine-3-carboxylic acid
CID 83869559
4-(1-chloroimidazo[1,5-a]pyridin-3-yl)phenol
CID 137005619
1-chloro-3-(4-methoxyphenyl)imidazo[1,5-a]pyridine
CID 117250855
1-(3-chloropyrazolo[1,5-a]pyridin-2-yl)ethanone
CID 83879148
1-chloro-7-(dimethylamino)imidazo[1,5-a]pyridine-3-carboxylic acid
CID 83898591
3-(1-chloroimidazo[1,5-a]pyridin-3-yl)-N-methylpropan-1-amine
CID 117253307
1-(2-tert-butylimidazo[1,2-a]pyridin-3-yl)ethanone
CID 84681820
1-chloro-3-(4-fluorophenyl)imidazo[1,5-a]pyridine
CID 117250849

Frequently Asked Questions

What is the IUPAC name of 1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone?
The IUPAC name of 1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone (CID 83879180) is 1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone.
What is the SMILES notation for 1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone?
The canonical SMILES for 1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone is CC(=O)c1nc(Cl)c2ccccn12.
What is the InChIKey of 1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone?
The InChIKey is SUSNABFYGGGBTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2O/c1-6(13)9-11-8(10)7-4-2-3-5-12(7)9/h2-5H,1H3.
What are the key properties of 1-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone?
1-(1-chloroimidazo[1,5-a]pyridin-3-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-(1-chloroimidazo[1,5-a]pyridin-3-yl)ethanone is sourced from PubChem (CID 83879180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).