3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid

C10H11N3O3 — CID 117254847

IUPAC3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCOc1cccn2c(CN)nc(C(=O)O)c12
InChIInChI=1S/C10H11N3O3/c1-16-6-3-2-4-13-7(5-11)12-8(9(6)13)10(14)15/h2-4H,5,11H2,1H3,(H,14,15)
InChIKeyIFCDHJNKPJSOOO-UHFFFAOYSA-N
MW221.22 g/mol
LogP0.50
Rot. Bonds3

About 3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid

3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid (PubChem CID 117254847) has the molecular formula C10H11N3O3 and a molecular weight of 221.22 g/mol. Its IUPAC name is 3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid.

Molecular Properties

Compound Name3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid
PubChem CID117254847
Molecular FormulaC10H11N3O3
Molecular Weight221.22 g/mol
Exact Mass221.08
IUPAC Name3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid
SMILESCOc1cccn2c(CN)nc(C(=O)O)c12
InChIInChI=1S/C10H11N3O3/c1-16-6-3-2-4-13-7(5-11)12-8(9(6)13)10(14)15/h2-4H,5,11H2,1H3,(H,14,15)
InChIKeyIFCDHJNKPJSOOO-UHFFFAOYSA-N
XLogP0.50
TPSA89.85 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

8-methoxy-3-(phenoxymethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117255555
8-methoxy-3-(piperidin-2-ylmethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117254731
8-amino-3-(methoxymethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117255640
8-hydroxy-3-(methoxymethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117255582
methyl 3-(aminomethyl)-8-bromoimidazo[1,5-a]pyridine-1-carboxylate
CID 117254883
8-amino-3-ethylimidazo[1,5-a]pyridine-1-carboxylic acid
CID 83832703
8-hydroxy-3-(2-methoxyethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117252133
3-(2-methoxyphenyl)imidazo[1,5-a]pyridine-1,8-dicarboxylic acid
CID 117252544
3-ethylimidazo[1,5-a]pyridine-1,8-dicarboxylic acid
CID 117252398
3-(2-aminoethyl)-8-bromoimidazo[1,5-a]pyridine-1-carboxylic acid
CID 84743573
3-(2-aminopropyl)-8-chloroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117254982
(8-methoxy-3-methylimidazo[1,2-a]pyridin-2-yl)methanamine
CID 115018583

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid?
The IUPAC name of 3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid (CID 117254847) is 3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid.
What is the SMILES notation for 3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid?
The canonical SMILES for 3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid is COc1cccn2c(CN)nc(C(=O)O)c12.
What is the InChIKey of 3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid?
The InChIKey is IFCDHJNKPJSOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3/c1-16-6-3-2-4-13-7(5-11)12-8(9(6)13)10(14)15/h2-4H,5,11H2,1H3,(H,14,15).
What are the key properties of 3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid?
3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid has a molecular weight of 221.22 g/mol, XLogP of 0.50, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-8-methoxyimidazo[1,5-a]pyridine-1-carboxylic acid is sourced from PubChem (CID 117254847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).