6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid

C12H12N2O2 — CID 139487962

IUPAC6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid
SMILESO=C(O)c1cn2cc(C3CCC3)ccc2n1
InChIInChI=1S/C12H12N2O2/c15-12(16)10-7-14-6-9(8-2-1-3-8)4-5-11(14)13-10/h4-8H,1-3H2,(H,15,16)
InChIKeyUKKWVRSEMMWQMM-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.30
Rot. Bonds2

About 6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid

6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid (PubChem CID 139487962) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid
PubChem CID139487962
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid
SMILESO=C(O)c1cn2cc(C3CCC3)ccc2n1
InChIInChI=1S/C12H12N2O2/c15-12(16)10-7-14-6-9(8-2-1-3-8)4-5-11(14)13-10/h4-8H,1-3H2,(H,15,16)
InChIKeyUKKWVRSEMMWQMM-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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Frequently Asked Questions

What is the IUPAC name of 6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid?
The IUPAC name of 6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid (CID 139487962) is 6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid?
The canonical SMILES for 6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid is O=C(O)c1cn2cc(C3CCC3)ccc2n1.
What is the InChIKey of 6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid?
The InChIKey is UKKWVRSEMMWQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c15-12(16)10-7-14-6-9(8-2-1-3-8)4-5-11(14)13-10/h4-8H,1-3H2,(H,15,16).
What are the key properties of 6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid?
6-cyclobutylimidazo[1,2-a]pyridine-2-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 6-cyclobutylimidazo[1,2-a]pyridine-2-carboxylic acid is sourced from PubChem (CID 139487962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).