3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid

C15H19N3O2 — CID 117147552

IUPAC3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid
SMILESCCN1CCCCC1c1ncc2c(C(=O)O)cccn12
InChIInChI=1S/C15H19N3O2/c1-2-17-8-4-3-7-12(17)14-16-10-13-11(15(19)20)6-5-9-18(13)14/h5-6,9-10,12H,2-4,7-8H2,1H3,(H,19,20)
InChIKeyRZIMRHYSRJABCY-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.58
Rot. Bonds3

About 3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid

3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid (PubChem CID 117147552) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid.

Molecular Properties

Compound Name3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid
PubChem CID117147552
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid
SMILESCCN1CCCCC1c1ncc2c(C(=O)O)cccn12
InChIInChI=1S/C15H19N3O2/c1-2-17-8-4-3-7-12(17)14-16-10-13-11(15(19)20)6-5-9-18(13)14/h5-6,9-10,12H,2-4,7-8H2,1H3,(H,19,20)
InChIKeyRZIMRHYSRJABCY-UHFFFAOYSA-N
XLogP2.58
TPSA57.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid?
The IUPAC name of 3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid (CID 117147552) is 3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid.
What is the SMILES notation for 3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid?
The canonical SMILES for 3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid is CCN1CCCCC1c1ncc2c(C(=O)O)cccn12.
What is the InChIKey of 3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid?
The InChIKey is RZIMRHYSRJABCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-2-17-8-4-3-7-12(17)14-16-10-13-11(15(19)20)6-5-9-18(13)14/h5-6,9-10,12H,2-4,7-8H2,1H3,(H,19,20).
What are the key properties of 3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid?
3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid has a molecular weight of 273.34 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethylpiperidin-2-yl)imidazo[1,5-a]pyridine-8-carboxylic acid is sourced from PubChem (CID 117147552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).