3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde

C11H14N4O — CID 84740202

IUPAC3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
SMILESCN(C)c1ccc2c(C=O)nc(CN)n2c1
InChIInChI=1S/C11H14N4O/c1-14(2)8-3-4-10-9(7-16)13-11(5-12)15(10)6-8/h3-4,6-7H,5,12H2,1-2H3
InChIKeyGLUVSOINTNSFNR-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.67
Rot. Bonds3

About 3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde

3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde (PubChem CID 84740202) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde.

Molecular Properties

Compound Name3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
PubChem CID84740202
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
SMILESCN(C)c1ccc2c(C=O)nc(CN)n2c1
InChIInChI=1S/C11H14N4O/c1-14(2)8-3-4-10-9(7-16)13-11(5-12)15(10)6-8/h3-4,6-7H,5,12H2,1-2H3
InChIKeyGLUVSOINTNSFNR-UHFFFAOYSA-N
XLogP0.67
TPSA63.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde?
The IUPAC name of 3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde (CID 84740202) is 3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde.
What is the SMILES notation for 3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde?
The canonical SMILES for 3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde is CN(C)c1ccc2c(C=O)nc(CN)n2c1.
What is the InChIKey of 3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde?
The InChIKey is GLUVSOINTNSFNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-14(2)8-3-4-10-9(7-16)13-11(5-12)15(10)6-8/h3-4,6-7H,5,12H2,1-2H3.
What are the key properties of 3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde?
3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde has a molecular weight of 218.26 g/mol, XLogP of 0.67, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde is sourced from PubChem (CID 84740202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).