2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine

C12H17N3 — CID 59534162

IUPAC2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine
SMILESCC(C)c1ccc2cc(C(C)C)nn2n1
InChIInChI=1S/C12H17N3/c1-8(2)11-6-5-10-7-12(9(3)4)14-15(10)13-11/h5-9H,1-4H3
InChIKeyVUBKQUYKXLBCAN-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.98
Rot. Bonds2

About 2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine

2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine (PubChem CID 59534162) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is 2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine.

Molecular Properties

Compound Name2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine
PubChem CID59534162
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine
SMILESCC(C)c1ccc2cc(C(C)C)nn2n1
InChIInChI=1S/C12H17N3/c1-8(2)11-6-5-10-7-12(9(3)4)14-15(10)13-11/h5-9H,1-4H3
InChIKeyVUBKQUYKXLBCAN-UHFFFAOYSA-N
XLogP2.98
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine 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 2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine?
The IUPAC name of 2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine (CID 59534162) is 2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine.
What is the SMILES notation for 2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine?
The canonical SMILES for 2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine is CC(C)c1ccc2cc(C(C)C)nn2n1.
What is the InChIKey of 2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine?
The InChIKey is VUBKQUYKXLBCAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-8(2)11-6-5-10-7-12(9(3)4)14-15(10)13-11/h5-9H,1-4H3.
What are the key properties of 2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine?
2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine has a molecular weight of 203.29 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-di(propan-2-yl)pyrazolo[1,5-b]pyridazine is sourced from PubChem (CID 59534162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).