5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid

C15H19N3O3 — CID 137005552

IUPAC5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCC(C)N1CCC(c2nc(C(=O)O)c3cccc(O)n23)C1
InChIInChI=1S/C15H19N3O3/c1-9(2)17-7-6-10(8-17)14-16-13(15(20)21)11-4-3-5-12(19)18(11)14/h3-5,9-10,19H,6-8H2,1-2H3,(H,20,21)
InChIKeyOBVZFIJTMOIPOV-UHFFFAOYSA-N
MW289.33 g/mol
LogP1.94
Rot. Bonds3

About 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid

5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 137005552) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID137005552
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCC(C)N1CCC(c2nc(C(=O)O)c3cccc(O)n23)C1
InChIInChI=1S/C15H19N3O3/c1-9(2)17-7-6-10(8-17)14-16-13(15(20)21)11-4-3-5-12(19)18(11)14/h3-5,9-10,19H,6-8H2,1-2H3,(H,20,21)
InChIKeyOBVZFIJTMOIPOV-UHFFFAOYSA-N
XLogP1.94
TPSA78.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid (CID 137005552) is 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid is CC(C)N1CCC(c2nc(C(=O)O)c3cccc(O)n23)C1.
What is the InChIKey of 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is OBVZFIJTMOIPOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-9(2)17-7-6-10(8-17)14-16-13(15(20)21)11-4-3-5-12(19)18(11)14/h3-5,9-10,19H,6-8H2,1-2H3,(H,20,21).
What are the key properties of 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 289.33 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-3-(1-propan-2-ylpyrrolidin-3-yl)imidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 137005552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).