5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine

C13H9ClFN3 — CID 59797172

IUPAC5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine
SMILESCn1nc(-c2cccc(F)c2)c2nc(Cl)ccc21
InChIInChI=1S/C13H9ClFN3/c1-18-10-5-6-11(14)16-13(10)12(17-18)8-3-2-4-9(15)7-8/h2-7H,1H3
InChIKeyJAYMIRIVPDOZBH-UHFFFAOYSA-N
MW261.69 g/mol
LogP3.43
Rot. Bonds1

About 5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine

5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine (PubChem CID 59797172) has the molecular formula C13H9ClFN3 and a molecular weight of 261.69 g/mol. Its IUPAC name is 5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine
PubChem CID59797172
Molecular FormulaC13H9ClFN3
Molecular Weight261.69 g/mol
Exact Mass261.05
IUPAC Name5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine
SMILESCn1nc(-c2cccc(F)c2)c2nc(Cl)ccc21
InChIInChI=1S/C13H9ClFN3/c1-18-10-5-6-11(14)16-13(10)12(17-18)8-3-2-4-9(15)7-8/h2-7H,1H3
InChIKeyJAYMIRIVPDOZBH-UHFFFAOYSA-N
XLogP3.43
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.69
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine?
The IUPAC name of 5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine (CID 59797172) is 5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine.
What is the SMILES notation for 5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine?
The canonical SMILES for 5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine is Cn1nc(-c2cccc(F)c2)c2nc(Cl)ccc21.
What is the InChIKey of 5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine?
The InChIKey is JAYMIRIVPDOZBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClFN3/c1-18-10-5-6-11(14)16-13(10)12(17-18)8-3-2-4-9(15)7-8/h2-7H,1H3.
What are the key properties of 5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine?
5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine has a molecular weight of 261.69 g/mol, XLogP of 3.43, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(3-fluorophenyl)-1-methylpyrazolo[4,3-b]pyridine is sourced from PubChem (CID 59797172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).