2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one

C9H9N3O — CID 86276588

IUPAC2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one
SMILESO=c1[nH]ccn2nc(C3CC3)cc12
InChIInChI=1S/C9H9N3O/c13-9-8-5-7(6-1-2-6)11-12(8)4-3-10-9/h3-6H,1-2H2,(H,10,13)
InChIKeyDVGHMPJBYNHGEA-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.90
Rot. Bonds1

About 2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one

2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one (PubChem CID 86276588) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one
PubChem CID86276588
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one
SMILESO=c1[nH]ccn2nc(C3CC3)cc12
InChIInChI=1S/C9H9N3O/c13-9-8-5-7(6-1-2-6)11-12(8)4-3-10-9/h3-6H,1-2H2,(H,10,13)
InChIKeyDVGHMPJBYNHGEA-UHFFFAOYSA-N
XLogP0.90
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one (CID 86276588) is 2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one is O=c1[nH]ccn2nc(C3CC3)cc12.
What is the InChIKey of 2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is DVGHMPJBYNHGEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c13-9-8-5-7(6-1-2-6)11-12(8)4-3-10-9/h3-6H,1-2H2,(H,10,13).
What are the key properties of 2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one?
2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 175.19 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5H-pyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 86276588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).