7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid

C14H17N3O3 — CID 117251690

IUPAC7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCN1CCC(c2nc(C(=O)O)c3cc(O)ccn23)CC1
InChIInChI=1S/C14H17N3O3/c1-16-5-2-9(3-6-16)13-15-12(14(19)20)11-8-10(18)4-7-17(11)13/h4,7-9,18H,2-3,5-6H2,1H3,(H,19,20)
InChIKeyTZNLHJHZTJURQV-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.55
Rot. Bonds2

About 7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid

7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 117251690) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID117251690
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCN1CCC(c2nc(C(=O)O)c3cc(O)ccn23)CC1
InChIInChI=1S/C14H17N3O3/c1-16-5-2-9(3-6-16)13-15-12(14(19)20)11-8-10(18)4-7-17(11)13/h4,7-9,18H,2-3,5-6H2,1H3,(H,19,20)
InChIKeyTZNLHJHZTJURQV-UHFFFAOYSA-N
XLogP1.55
TPSA78.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid (CID 117251690) is 7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid is CN1CCC(c2nc(C(=O)O)c3cc(O)ccn23)CC1.
What is the InChIKey of 7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is TZNLHJHZTJURQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-16-5-2-9(3-6-16)13-15-12(14(19)20)11-8-10(18)4-7-17(11)13/h4,7-9,18H,2-3,5-6H2,1H3,(H,19,20).
What are the key properties of 7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid?
7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 275.31 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-3-(1-methylpiperidin-4-yl)imidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 117251690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).