3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine

C14H13ClN4 — CID 24751991

IUPAC3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine
SMILESCC(C)c1nn2ccccc2c1-c1ccc(Cl)nn1
InChIInChI=1S/C14H13ClN4/c1-9(2)14-13(10-6-7-12(15)17-16-10)11-5-3-4-8-19(11)18-14/h3-9H,1-2H3
InChIKeyWYMGHYURHRYYAB-UHFFFAOYSA-N
MW272.74 g/mol
LogP3.57
Rot. Bonds2

About 3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine

3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine (PubChem CID 24751991) has the molecular formula C14H13ClN4 and a molecular weight of 272.74 g/mol. Its IUPAC name is 3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine
PubChem CID24751991
Molecular FormulaC14H13ClN4
Molecular Weight272.74 g/mol
Exact Mass272.08
IUPAC Name3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine
SMILESCC(C)c1nn2ccccc2c1-c1ccc(Cl)nn1
InChIInChI=1S/C14H13ClN4/c1-9(2)14-13(10-6-7-12(15)17-16-10)11-5-3-4-8-19(11)18-14/h3-9H,1-2H3
InChIKeyWYMGHYURHRYYAB-UHFFFAOYSA-N
XLogP3.57
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.74
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine?
The IUPAC name of 3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine (CID 24751991) is 3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine.
What is the SMILES notation for 3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine?
The canonical SMILES for 3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine is CC(C)c1nn2ccccc2c1-c1ccc(Cl)nn1.
What is the InChIKey of 3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine?
The InChIKey is WYMGHYURHRYYAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN4/c1-9(2)14-13(10-6-7-12(15)17-16-10)11-5-3-4-8-19(11)18-14/h3-9H,1-2H3.
What are the key properties of 3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine?
3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine has a molecular weight of 272.74 g/mol, XLogP of 3.57, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-chloropyridazin-3-yl)-2-propan-2-ylpyrazolo[1,5-a]pyridine is sourced from PubChem (CID 24751991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).