1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine

C13H9Cl2N3 — CID 142719630

IUPAC1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine
SMILESClc1ccc(Cn2ncc3ncccc32)c(Cl)c1
InChIInChI=1S/C13H9Cl2N3/c14-10-4-3-9(11(15)6-10)8-18-13-2-1-5-16-12(13)7-17-18/h1-7H,8H2
InChIKeyHVODSZXUFDYLKA-UHFFFAOYSA-N
MW278.14 g/mol
LogP3.79
Rot. Bonds2

About 1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine

1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine (PubChem CID 142719630) has the molecular formula C13H9Cl2N3 and a molecular weight of 278.14 g/mol. Its IUPAC name is 1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine.

Molecular Properties

Compound Name1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine
PubChem CID142719630
Molecular FormulaC13H9Cl2N3
Molecular Weight278.14 g/mol
Exact Mass277.02
IUPAC Name1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine
SMILESClc1ccc(Cn2ncc3ncccc32)c(Cl)c1
InChIInChI=1S/C13H9Cl2N3/c14-10-4-3-9(11(15)6-10)8-18-13-2-1-5-16-12(13)7-17-18/h1-7H,8H2
InChIKeyHVODSZXUFDYLKA-UHFFFAOYSA-N
XLogP3.79
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.14
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine?
The IUPAC name of 1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine (CID 142719630) is 1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine.
What is the SMILES notation for 1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine?
The canonical SMILES for 1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine is Clc1ccc(Cn2ncc3ncccc32)c(Cl)c1.
What is the InChIKey of 1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine?
The InChIKey is HVODSZXUFDYLKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9Cl2N3/c14-10-4-3-9(11(15)6-10)8-18-13-2-1-5-16-12(13)7-17-18/h1-7H,8H2.
What are the key properties of 1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine?
1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine has a molecular weight of 278.14 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,4-dichlorophenyl)methyl]pyrazolo[4,5-b]pyridine is sourced from PubChem (CID 142719630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).