1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid

C13H13ClN2O2 — CID 117250887

IUPAC1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid
SMILESO=C(O)c1cccc2c(Cl)nc(C3CCCC3)n12
InChIInChI=1S/C13H13ClN2O2/c14-11-9-6-3-7-10(13(17)18)16(9)12(15-11)8-4-1-2-5-8/h3,6-8H,1-2,4-5H2,(H,17,18)
InChIKeyHRUQEWULOUCKAN-UHFFFAOYSA-N
MW264.71 g/mol
LogP3.34
Rot. Bonds2

About 1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid

1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid (PubChem CID 117250887) has the molecular formula C13H13ClN2O2 and a molecular weight of 264.71 g/mol. Its IUPAC name is 1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid
PubChem CID117250887
Molecular FormulaC13H13ClN2O2
Molecular Weight264.71 g/mol
Exact Mass264.07
IUPAC Name1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid
SMILESO=C(O)c1cccc2c(Cl)nc(C3CCCC3)n12
InChIInChI=1S/C13H13ClN2O2/c14-11-9-6-3-7-10(13(17)18)16(9)12(15-11)8-4-1-2-5-8/h3,6-8H,1-2,4-5H2,(H,17,18)
InChIKeyHRUQEWULOUCKAN-UHFFFAOYSA-N
XLogP3.34
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.71
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclobutyl-1-methylimidazo[1,5-a]pyridine-5-carboxylic acid
CID 83840388
1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-5-amine
CID 83869325
3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid
CID 83835843
3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridine-5-carboxylic acid
CID 83686835
1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-5-ol
CID 117250398
1-chloro-3-(2-methylphenyl)imidazo[1,5-a]pyridine-5-carboxylic acid
CID 117250730
3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1,5-dicarboxylic acid
CID 117250287
1-(1-bromo-3-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanone
CID 83904648
1-chloro-3-(3-hydroxyphenyl)imidazo[1,5-a]pyridine-5-carboxylic acid
CID 117250659
5-chloro-3-piperidin-4-ylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117252845
3-chloro-1-methylimidazo[1,5-a]pyridine-5-carboxylic acid
CID 83834906
5-amino-3-(azepan-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117252921

Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid?
The IUPAC name of 1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid (CID 117250887) is 1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid.
What is the SMILES notation for 1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid?
The canonical SMILES for 1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid is O=C(O)c1cccc2c(Cl)nc(C3CCCC3)n12.
What is the InChIKey of 1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid?
The InChIKey is HRUQEWULOUCKAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN2O2/c14-11-9-6-3-7-10(13(17)18)16(9)12(15-11)8-4-1-2-5-8/h3,6-8H,1-2,4-5H2,(H,17,18).
What are the key properties of 1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid?
1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid has a molecular weight of 264.71 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid is sourced from PubChem (CID 117250887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).