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

C14H15ClN2O — CID 129097639

IUPAC1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone
SMILESCC(=O)c1cc(Cl)c2cncn2c1C1CCCC1
InChIInChI=1S/C14H15ClN2O/c1-9(18)11-6-12(15)13-7-16-8-17(13)14(11)10-4-2-3-5-10/h6-8,10H,2-5H2,1H3
InChIKeyLLPATWPHYSIJQK-UHFFFAOYSA-N
MW262.74 g/mol
LogP3.85
Rot. Bonds2

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

1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone (PubChem CID 129097639) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is 1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone.

Molecular Properties

Compound Name1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone
PubChem CID129097639
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC Name1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone
SMILESCC(=O)c1cc(Cl)c2cncn2c1C1CCCC1
InChIInChI=1S/C14H15ClN2O/c1-9(18)11-6-12(15)13-7-16-8-17(13)14(11)10-4-2-3-5-10/h6-8,10H,2-5H2,1H3
InChIKeyLLPATWPHYSIJQK-UHFFFAOYSA-N
XLogP3.85
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone?
The IUPAC name of 1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone (CID 129097639) is 1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone.
What is the SMILES notation for 1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone?
The canonical SMILES for 1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone is CC(=O)c1cc(Cl)c2cncn2c1C1CCCC1.
What is the InChIKey of 1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone?
The InChIKey is LLPATWPHYSIJQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c1-9(18)11-6-12(15)13-7-16-8-17(13)14(11)10-4-2-3-5-10/h6-8,10H,2-5H2,1H3.
What are the key properties of 1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone?
1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone has a molecular weight of 262.74 g/mol, XLogP of 3.85, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-chloro-5-cyclopentylimidazo[1,5-a]pyridin-6-yl)ethanone is sourced from PubChem (CID 129097639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).