7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde

C9H7BrN2O2 — CID 83488501

IUPAC7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde
SMILESCOc1cc(Br)n2ncc(C=O)c2c1
InChIInChI=1S/C9H7BrN2O2/c1-14-7-2-8-6(5-13)4-11-12(8)9(10)3-7/h2-5H,1H3
InChIKeyVZXZWXPVANCOMY-UHFFFAOYSA-N
MW255.07 g/mol
LogP1.92
Rot. Bonds2

About 7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde

7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde (PubChem CID 83488501) has the molecular formula C9H7BrN2O2 and a molecular weight of 255.07 g/mol. Its IUPAC name is 7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde
PubChem CID83488501
Molecular FormulaC9H7BrN2O2
Molecular Weight255.07 g/mol
Exact Mass253.97
IUPAC Name7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde
SMILESCOc1cc(Br)n2ncc(C=O)c2c1
InChIInChI=1S/C9H7BrN2O2/c1-14-7-2-8-6(5-13)4-11-12(8)9(10)3-7/h2-5H,1H3
InChIKeyVZXZWXPVANCOMY-UHFFFAOYSA-N
XLogP1.92
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.07
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3-formyl-4,6-dimethoxyindol-1-yl)-4-oxobutanoic acid
CID 83971011
3-bromo-5-methoxypyridine-2-carbaldehyde
CID 83886920
5-(3-methoxyphenyl)-1-methylpyrazole-4-carbaldehyde
CID 83821629
3,5-dimethoxy-2-methylbenzaldehyde
CID 10214428
5,7-dimethoxy-6-methylpyrazolo[1,5-a]pyrimidine-3-carbaldehyde
CID 105477090
5-methoxy-1-phenylpyrazole-4-carbaldehyde
CID 131583769
6-bromopyrazolo[1,5-a]pyrazine-3-carbaldehyde
CID 164559883
2-bromo-4-propan-2-yloxybenzaldehyde
CID 104573949
5-methoxy-2-pyrrol-1-ylbenzaldehyde
CID 121010613
2-(4-chloropyrazol-1-yl)-5-methoxybenzaldehyde
CID 58542008
5-bromo-7-methoxyimidazo[1,2-a]pyridine-3-carboxamide;5-bromo-7-methoxyimidazo[1,2-a]pyridine-3-carboxylic acid
CID 167613235
propan-2-yl 2-(3-formyl-4,6-dimethoxyindol-1-yl)propanoate
CID 110832215

Frequently Asked Questions

What is the IUPAC name of 7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde?
The IUPAC name of 7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde (CID 83488501) is 7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde?
The canonical SMILES for 7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde is COc1cc(Br)n2ncc(C=O)c2c1.
What is the InChIKey of 7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde?
The InChIKey is VZXZWXPVANCOMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7BrN2O2/c1-14-7-2-8-6(5-13)4-11-12(8)9(10)3-7/h2-5H,1H3.
What are the key properties of 7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde?
7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde has a molecular weight of 255.07 g/mol, XLogP of 1.92, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-5-methoxypyrazolo[1,5-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 83488501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).