2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione

C7H8N2O2 — CID 45121280

IUPAC2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione
SMILESO=c1ccc(=O)n2n1CCC2
InChIInChI=1S/C7H8N2O2/c10-6-2-3-7(11)9-5-1-4-8(6)9/h2-3H,1,4-5H2
InChIKeyHFHJOSGOGRYMIZ-UHFFFAOYSA-N
MW152.15 g/mol
LogP-0.59
Rot. Bonds

About 2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione

2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione (PubChem CID 45121280) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione.

Molecular Properties

Compound Name2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione
PubChem CID45121280
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione
SMILESO=c1ccc(=O)n2n1CCC2
InChIInChI=1S/C7H8N2O2/c10-6-2-3-7(11)9-5-1-4-8(6)9/h2-3H,1,4-5H2
InChIKeyHFHJOSGOGRYMIZ-UHFFFAOYSA-N
XLogP-0.59
TPSA44.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 5-0.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione?
The IUPAC name of 2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione (CID 45121280) is 2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione.
What is the SMILES notation for 2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione?
The canonical SMILES for 2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione is O=c1ccc(=O)n2n1CCC2.
What is the InChIKey of 2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione?
The InChIKey is HFHJOSGOGRYMIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c10-6-2-3-7(11)9-5-1-4-8(6)9/h2-3H,1,4-5H2.
What are the key properties of 2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione?
2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione has a molecular weight of 152.15 g/mol, XLogP of -0.59, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-pyrazolo[1,2-a]pyridazine-5,8-dione is sourced from PubChem (CID 45121280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).