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

C15H19N3O2 — CID 43584666

IUPAC2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCCC1CCCN(c2nc3ccccn3c2C(=O)O)C1
InChIInChI=1S/C15H19N3O2/c1-2-11-6-5-8-17(10-11)14-13(15(19)20)18-9-4-3-7-12(18)16-14/h3-4,7,9,11H,2,5-6,8,10H2,1H3,(H,19,20)
InChIKeyMSPGYSQGQKISMG-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.66
Rot. Bonds3

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

2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid (PubChem CID 43584666) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
PubChem CID43584666
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
SMILESCCC1CCCN(c2nc3ccccn3c2C(=O)O)C1
InChIInChI=1S/C15H19N3O2/c1-2-11-6-5-8-17(10-11)14-13(15(19)20)18-9-4-3-7-12(18)16-14/h3-4,7,9,11H,2,5-6,8,10H2,1H3,(H,19,20)
InChIKeyMSPGYSQGQKISMG-UHFFFAOYSA-N
XLogP2.66
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 ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-(aminomethyl)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 62063458
3-(chloromethyl)-2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine
CID 43584737
2-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 61227192
2-(4-methylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 43477803
2-[3-(dimethylamino)pyrrolidin-1-yl]imidazo[1,2-a]pyridine-3-carboxylic acid
CID 63163885
2-(3-hydroxy-4-methylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 102958616
2-(2-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 43477885
2-(2-ethylazepan-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 104690132
2-(2-carbamoylpyrrolidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 43477869
2-[3-(methoxymethyl)piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 106587506
2-(3,5-dioxopiperazin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 66083555
2-(3-ethylpiperidin-1-yl)pyridine-3-carboxylic acid
CID 43430341

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
The IUPAC name of 2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid (CID 43584666) is 2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid.
What is the SMILES notation for 2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
The canonical SMILES for 2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid is CCC1CCCN(c2nc3ccccn3c2C(=O)O)C1.
What is the InChIKey of 2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
The InChIKey is MSPGYSQGQKISMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-2-11-6-5-8-17(10-11)14-13(15(19)20)18-9-4-3-7-12(18)16-14/h3-4,7,9,11H,2,5-6,8,10H2,1H3,(H,19,20).
What are the key properties of 2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid?
2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid has a molecular weight of 273.34 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylpiperidin-1-yl)imidazo[1,2-a]pyridine-3-carboxylic acid is sourced from PubChem (CID 43584666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).