6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine

C15H14ClN3O2 — CID 175944905

IUPAC6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine
SMILESCCOc1nc(Cl)cc2c1cnn2-c1cccc(OC)c1
InChIInChI=1S/C15H14ClN3O2/c1-3-21-15-12-9-17-19(13(12)8-14(16)18-15)10-5-4-6-11(7-10)20-2/h4-9H,3H2,1-2H3
InChIKeyYLYSGZATUOJXCK-UHFFFAOYSA-N
MW303.75 g/mol
LogP3.48
Rot. Bonds4

About 6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine

6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine (PubChem CID 175944905) has the molecular formula C15H14ClN3O2 and a molecular weight of 303.75 g/mol. Its IUPAC name is 6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine
PubChem CID175944905
Molecular FormulaC15H14ClN3O2
Molecular Weight303.75 g/mol
Exact Mass303.08
IUPAC Name6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine
SMILESCCOc1nc(Cl)cc2c1cnn2-c1cccc(OC)c1
InChIInChI=1S/C15H14ClN3O2/c1-3-21-15-12-9-17-19(13(12)8-14(16)18-15)10-5-4-6-11(7-10)20-2/h4-9H,3H2,1-2H3
InChIKeyYLYSGZATUOJXCK-UHFFFAOYSA-N
XLogP3.48
TPSA49.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.75
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine?
The IUPAC name of 6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine (CID 175944905) is 6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine?
The canonical SMILES for 6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine is CCOc1nc(Cl)cc2c1cnn2-c1cccc(OC)c1.
What is the InChIKey of 6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine?
The InChIKey is YLYSGZATUOJXCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3O2/c1-3-21-15-12-9-17-19(13(12)8-14(16)18-15)10-5-4-6-11(7-10)20-2/h4-9H,3H2,1-2H3.
What are the key properties of 6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine?
6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine has a molecular weight of 303.75 g/mol, XLogP of 3.48, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-ethoxy-1-(3-methoxyphenyl)pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 175944905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).