3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid

C12H12N2O2 — CID 83835843

IUPAC3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid
SMILESO=C(O)c1cccc2cnc(C3CCC3)n12
InChIInChI=1S/C12H12N2O2/c15-12(16)10-6-2-5-9-7-13-11(14(9)10)8-3-1-4-8/h2,5-8H,1,3-4H2,(H,15,16)
InChIKeyQRNBZGYFRVJUMQ-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.30
Rot. Bonds2

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

3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid (PubChem CID 83835843) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid.

Molecular Properties

Compound Name3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid
PubChem CID83835843
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid
SMILESO=C(O)c1cccc2cnc(C3CCC3)n12
InChIInChI=1S/C12H12N2O2/c15-12(16)10-6-2-5-9-7-13-11(14(9)10)8-3-1-4-8/h2,5-8H,1,3-4H2,(H,15,16)
InChIKeyQRNBZGYFRVJUMQ-UHFFFAOYSA-N
XLogP2.30
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1,1-dioxothian-3-yl)imidazo[1,5-a]pyridine-5-carboxylic acid
CID 117142556
3-(thiolan-3-yl)imidazo[1,5-a]pyridine-5-carboxylic acid
CID 117142453
methyl 3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylate
CID 117142874
3-(1-methylpiperidin-2-yl)imidazo[1,5-a]pyridine-5-carboxylic acid
CID 117142621
methyl 3-cyclopropylimidazo[1,5-a]pyridine-5-carboxylate
CID 117142870
3-cyclobutyl-1-methylimidazo[1,5-a]pyridine-5-carboxylic acid
CID 83840388
2-amino-2-(3-cyclopropylimidazo[1,5-a]pyridin-5-yl)acetic acid
CID 83840685
3-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridine-5-carboxylic acid
CID 83686835
1-chloro-3-cyclopentylimidazo[1,5-a]pyridine-5-carboxylic acid
CID 117250887
3-cyclobutylimidazo[1,5-a]pyridine-6-carboxylic acid
CID 83835844
2-(3-cyclobutylimidazo[1,5-a]pyridin-5-yl)propan-1-amine
CID 83893835
2-cyclopentyl-3-methylimidazole-4-carboxylic acid
CID 82375323

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid?
The IUPAC name of 3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid (CID 83835843) is 3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid.
What is the SMILES notation for 3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid?
The canonical SMILES for 3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid is O=C(O)c1cccc2cnc(C3CCC3)n12.
What is the InChIKey of 3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid?
The InChIKey is QRNBZGYFRVJUMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c15-12(16)10-6-2-5-9-7-13-11(14(9)10)8-3-1-4-8/h2,5-8H,1,3-4H2,(H,15,16).
What are the key properties of 3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid?
3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid has a molecular weight of 216.24 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutylimidazo[1,5-a]pyridine-5-carboxylic acid is sourced from PubChem (CID 83835843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).