2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione

C11H10N2O2 — CID 15707699

IUPAC2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione
SMILESO=c1c2ccccc2c(=O)n2n1CCC2
InChIInChI=1S/C11H10N2O2/c14-10-8-4-1-2-5-9(8)11(15)13-7-3-6-12(10)13/h1-2,4-5H,3,6-7H2
InChIKeyYFYRLBWOIHIZCK-UHFFFAOYSA-N
MW202.21 g/mol
LogP0.57
Rot. Bonds

About 2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione

2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione (PubChem CID 15707699) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione.

Molecular Properties

Compound Name2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione
PubChem CID15707699
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione
SMILESO=c1c2ccccc2c(=O)n2n1CCC2
InChIInChI=1S/C11H10N2O2/c14-10-8-4-1-2-5-9(8)11(15)13-7-3-6-12(10)13/h1-2,4-5H,3,6-7H2
InChIKeyYFYRLBWOIHIZCK-UHFFFAOYSA-N
XLogP0.57
TPSA44.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 50.57
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-b]phthalazine-5,10-dione?
The IUPAC name of 2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione (CID 15707699) is 2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione.
What is the SMILES notation for 2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione?
The canonical SMILES for 2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione is O=c1c2ccccc2c(=O)n2n1CCC2.
What is the InChIKey of 2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione?
The InChIKey is YFYRLBWOIHIZCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c14-10-8-4-1-2-5-9(8)11(15)13-7-3-6-12(10)13/h1-2,4-5H,3,6-7H2.
What are the key properties of 2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione?
2,3-dihydro-1H-pyrazolo[1,2-b]phthalazine-5,10-dione has a molecular weight of 202.21 g/mol, XLogP of 0.57, 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-b]phthalazine-5,10-dione is sourced from PubChem (CID 15707699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).