3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid

C11H11N3O3 — CID 117253497

IUPAC3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid
SMILESO=C(O)c1nc(C2CNC2)n2cc(O)ccc12
InChIInChI=1S/C11H11N3O3/c15-7-1-2-8-9(11(16)17)13-10(14(8)5-7)6-3-12-4-6/h1-2,5-6,12,15H,3-4H2,(H,16,17)
InChIKeyIMEONVHTUKANFX-UHFFFAOYSA-N
MW233.23 g/mol
LogP0.42
Rot. Bonds2

About 3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid

3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 117253497) has the molecular formula C11H11N3O3 and a molecular weight of 233.23 g/mol. Its IUPAC name is 3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID117253497
Molecular FormulaC11H11N3O3
Molecular Weight233.23 g/mol
Exact Mass233.08
IUPAC Name3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid
SMILESO=C(O)c1nc(C2CNC2)n2cc(O)ccc12
InChIInChI=1S/C11H11N3O3/c15-7-1-2-8-9(11(16)17)13-10(14(8)5-7)6-3-12-4-6/h1-2,5-6,12,15H,3-4H2,(H,16,17)
InChIKeyIMEONVHTUKANFX-UHFFFAOYSA-N
XLogP0.42
TPSA86.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 50.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid (CID 117253497) is 3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid is O=C(O)c1nc(C2CNC2)n2cc(O)ccc12.
What is the InChIKey of 3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is IMEONVHTUKANFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O3/c15-7-1-2-8-9(11(16)17)13-10(14(8)5-7)6-3-12-4-6/h1-2,5-6,12,15H,3-4H2,(H,16,17).
What are the key properties of 3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid?
3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 233.23 g/mol, XLogP of 0.42, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(azetidin-3-yl)-6-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 117253497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).