3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde

C10H10BrN3O — CID 84743006

IUPAC3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde
SMILESNCCc1nc(C=O)c2cccc(Br)n12
InChIInChI=1S/C10H10BrN3O/c11-9-3-1-2-8-7(6-15)13-10(4-5-12)14(8)9/h1-3,6H,4-5,12H2
InChIKeyQAMLCIFHARBQLF-UHFFFAOYSA-N
MW268.11 g/mol
LogP1.41
Rot. Bonds3

About 3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde

3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde (PubChem CID 84743006) has the molecular formula C10H10BrN3O and a molecular weight of 268.11 g/mol. Its IUPAC name is 3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde.

Molecular Properties

Compound Name3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde
PubChem CID84743006
Molecular FormulaC10H10BrN3O
Molecular Weight268.11 g/mol
Exact Mass267.00
IUPAC Name3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde
SMILESNCCc1nc(C=O)c2cccc(Br)n12
InChIInChI=1S/C10H10BrN3O/c11-9-3-1-2-8-7(6-15)13-10(4-5-12)14(8)9/h1-3,6H,4-5,12H2
InChIKeyQAMLCIFHARBQLF-UHFFFAOYSA-N
XLogP1.41
TPSA60.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.11
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

5-bromo-3-[(4-methoxyphenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84745312
5-bromo-3-(trifluoromethyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743818
5-bromo-3-tert-butylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743489
3-(2-aminoethyl)-8-bromoimidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743000
5-bromo-3-cyclopentylimidazo[1,5-a]pyridine-1-carbaldehyde
CID 84743823
3-(2-aminoethyl)-1-bromoimidazo[1,5-a]pyridin-5-ol
CID 117253162
3-(3-aminopropyl)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84760068
2-(5-bromoimidazo[1,5-a]pyridin-3-yl)ethanamine
CID 83843084
3-(aminomethyl)-5-bromoimidazo[1,5-a]pyridine-1-carboxylic acid
CID 84743102
1,5-dibromo-3-ethylimidazo[1,5-a]pyridine
CID 84744172
3-(2-aminoethyl)-5-hydroxyimidazo[1,5-a]pyridine-1-carboxylic acid
CID 137005753
3-(aminomethyl)-6-(dimethylamino)imidazo[1,5-a]pyridine-1-carbaldehyde
CID 84740202

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde?
The IUPAC name of 3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde (CID 84743006) is 3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde.
What is the SMILES notation for 3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde?
The canonical SMILES for 3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde is NCCc1nc(C=O)c2cccc(Br)n12.
What is the InChIKey of 3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde?
The InChIKey is QAMLCIFHARBQLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3O/c11-9-3-1-2-8-7(6-15)13-10(4-5-12)14(8)9/h1-3,6H,4-5,12H2.
What are the key properties of 3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde?
3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde has a molecular weight of 268.11 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-5-bromoimidazo[1,5-a]pyridine-1-carbaldehyde is sourced from PubChem (CID 84743006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).