4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine

C7H6ClN3O — CID 86717818

IUPAC4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine
SMILESCOc1cnc(Cl)c2cn[nH]c12
InChIInChI=1S/C7H6ClN3O/c1-12-5-3-9-7(8)4-2-10-11-6(4)5/h2-3H,1H3,(H,10,11)
InChIKeyWRGFAMAOTQLQDL-UHFFFAOYSA-N
MW183.60 g/mol
LogP1.62
Rot. Bonds1

About 4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine

4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine (PubChem CID 86717818) has the molecular formula C7H6ClN3O and a molecular weight of 183.60 g/mol. Its IUPAC name is 4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine.

Molecular Properties

Compound Name4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine
PubChem CID86717818
Molecular FormulaC7H6ClN3O
Molecular Weight183.60 g/mol
Exact Mass183.02
IUPAC Name4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine
SMILESCOc1cnc(Cl)c2cn[nH]c12
InChIInChI=1S/C7H6ClN3O/c1-12-5-3-9-7(8)4-2-10-11-6(4)5/h2-3H,1H3,(H,10,11)
InChIKeyWRGFAMAOTQLQDL-UHFFFAOYSA-N
XLogP1.62
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.60
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-chloro-7-methoxy-1H-pyrazolo[4,5-c]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 4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine?
The IUPAC name of 4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine (CID 86717818) is 4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine.
What is the SMILES notation for 4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine?
The canonical SMILES for 4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine is COc1cnc(Cl)c2cn[nH]c12.
What is the InChIKey of 4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine?
The InChIKey is WRGFAMAOTQLQDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN3O/c1-12-5-3-9-7(8)4-2-10-11-6(4)5/h2-3H,1H3,(H,10,11).
What are the key properties of 4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine?
4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine has a molecular weight of 183.60 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-7-methoxy-1H-pyrazolo[4,5-c]pyridine is sourced from PubChem (CID 86717818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).