7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine

C8H10N4 — CID 171591295

IUPAC7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine
SMILESCC(C)c1cnnc2cn[nH]c12
InChIInChI=1S/C8H10N4/c1-5(2)6-3-9-11-7-4-10-12-8(6)7/h3-5H,1-2H3,(H,10,12)
InChIKeyAZXIBHYCOLGYAD-UHFFFAOYSA-N
MW162.20 g/mol
LogP1.48
Rot. Bonds1

About 7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine

7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine (PubChem CID 171591295) has the molecular formula C8H10N4 and a molecular weight of 162.20 g/mol. Its IUPAC name is 7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine.

Molecular Properties

Compound Name7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine
PubChem CID171591295
Molecular FormulaC8H10N4
Molecular Weight162.20 g/mol
Exact Mass162.09
IUPAC Name7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine
SMILESCC(C)c1cnnc2cn[nH]c12
InChIInChI=1S/C8H10N4/c1-5(2)6-3-9-11-7-4-10-12-8(6)7/h3-5H,1-2H3,(H,10,12)
InChIKeyAZXIBHYCOLGYAD-UHFFFAOYSA-N
XLogP1.48
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine?
The IUPAC name of 7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine (CID 171591295) is 7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine.
What is the SMILES notation for 7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine?
The canonical SMILES for 7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine is CC(C)c1cnnc2cn[nH]c12.
What is the InChIKey of 7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine?
The InChIKey is AZXIBHYCOLGYAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4/c1-5(2)6-3-9-11-7-4-10-12-8(6)7/h3-5H,1-2H3,(H,10,12).
What are the key properties of 7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine?
7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine has a molecular weight of 162.20 g/mol, XLogP of 1.48, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-propan-2-yl-1H-pyrazolo[4,5-c]pyridazine is sourced from PubChem (CID 171591295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).