3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde

C8H5BrN2O — CID 131491052

IUPAC3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde
SMILESO=Cc1ccn2ncc(Br)c2c1
InChIInChI=1S/C8H5BrN2O/c9-7-4-10-11-2-1-6(5-12)3-8(7)11/h1-5H
InChIKeyJHCBJQAWIVCEPK-UHFFFAOYSA-N
MW225.05 g/mol
LogP1.91
Rot. Bonds1

About 3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde

3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde (PubChem CID 131491052) has the molecular formula C8H5BrN2O and a molecular weight of 225.05 g/mol. Its IUPAC name is 3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde.

Molecular Properties

Compound Name3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde
PubChem CID131491052
Molecular FormulaC8H5BrN2O
Molecular Weight225.05 g/mol
Exact Mass223.96
IUPAC Name3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde
SMILESO=Cc1ccn2ncc(Br)c2c1
InChIInChI=1S/C8H5BrN2O/c9-7-4-10-11-2-1-6(5-12)3-8(7)11/h1-5H
InChIKeyJHCBJQAWIVCEPK-UHFFFAOYSA-N
XLogP1.91
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.05
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-bromopyrazolo[1,5-a]pyridine-5-carboxamide
CID 171597831
3-bromo-5-phenylpyrazolo[1,5-a]pyridine
CID 71741646
pyrazolo[1,5-a]pyridine-5-carbaldehyde
CID 10986375
tert-butyl N-(3-bromopyrazolo[1,5-a]pyridin-5-yl)carbamate
CID 90175973
2-(2-bromophenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carbaldehyde
CID 117135404
3-bromo-N-(2-methylphenyl)pyrazolo[1,5-a]pyridine-5-carboxamide
CID 90193866
3-bromo-[1,2,4]triazolo[4,3-a]pyridine-7-carbaldehyde
CID 82391567
3-formylpyrazolo[1,5-a]pyridine-5-carboxylic acid
CID 59476245
3-bromopyrazolo[1,5-a]pyridine;1-bromopyrrolidine-2,5-dione
CID 159601525
1-bromo-3-cyclobutylimidazo[1,5-a]pyridine-7-carbaldehyde
CID 83904653
3-formylpyrazolo[1,5-a]pyridine-5-carboxamide
CID 25171438
3-bromo-5-chloro-6-fluoropyrazolo[1,5-a]pyridine
CID 130066078

Frequently Asked Questions

What is the IUPAC name of 3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde?
The IUPAC name of 3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde (CID 131491052) is 3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde.
What is the SMILES notation for 3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde?
The canonical SMILES for 3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde is O=Cc1ccn2ncc(Br)c2c1.
What is the InChIKey of 3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde?
The InChIKey is JHCBJQAWIVCEPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5BrN2O/c9-7-4-10-11-2-1-6(5-12)3-8(7)11/h1-5H.
What are the key properties of 3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde?
3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde has a molecular weight of 225.05 g/mol, XLogP of 1.91, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromopyrazolo[1,5-a]pyridine-5-carbaldehyde is sourced from PubChem (CID 131491052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).