3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde

C11H13N3O — CID 84760068

IUPAC3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde
SMILESNCCCc1nc(C=O)c2ccccn12
InChIInChI=1S/C11H13N3O/c12-6-3-5-11-13-9(8-15)10-4-1-2-7-14(10)11/h1-2,4,7-8H,3,5-6,12H2
InChIKeyRIBNZSUCNPTFPK-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.04
Rot. Bonds4

About 3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde

3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde (PubChem CID 84760068) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde.

Molecular Properties

Compound Name3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde
PubChem CID84760068
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde
SMILESNCCCc1nc(C=O)c2ccccn12
InChIInChI=1S/C11H13N3O/c12-6-3-5-11-13-9(8-15)10-4-1-2-7-14(10)11/h1-2,4,7-8H,3,5-6,12H2
InChIKeyRIBNZSUCNPTFPK-UHFFFAOYSA-N
XLogP1.04
TPSA60.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[2-(4-fluorophenyl)ethyl]imidazo[1,5-a]pyridine-1-carbaldehyde
CID 28752029
CID 89207227
CID 89207227
3-(2-aminoethyl)-8-bromoimidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743000
3-(3,4-difluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 82483282
3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine
CID 94231471
3-thiophen-2-ylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 957617
3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743006
3-cyclobutylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 83831717
1-phenyl-3-[2-(1-phenylimidazo[1,5-a]pyridin-3-yl)ethyl]imidazo[1,5-a]pyridine
CID 132506858
3-(3,5-dimethoxyphenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 28752017
3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84740202
3-(5-bromo-2-fluorophenyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 116836651

Frequently Asked Questions

What is the IUPAC name of 3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The IUPAC name of 3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde (CID 84760068) is 3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde.
What is the SMILES notation for 3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The canonical SMILES for 3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde is NCCCc1nc(C=O)c2ccccn12.
What is the InChIKey of 3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
The InChIKey is RIBNZSUCNPTFPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c12-6-3-5-11-13-9(8-15)10-4-1-2-7-14(10)11/h1-2,4,7-8H,3,5-6,12H2.
What are the key properties of 3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde?
3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde has a molecular weight of 203.25 g/mol, XLogP of 1.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde is sourced from PubChem (CID 84760068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).