5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

C15H17N3O2 — CID 53305005

IUPAC5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESO=C1c2cc(-c3ccccc3)nn2CCN1CCCO
InChIInChI=1S/C15H17N3O2/c19-10-4-7-17-8-9-18-14(15(17)20)11-13(16-18)12-5-2-1-3-6-12/h1-3,5-6,11,19H,4,7-10H2
InChIKeyKARKBIOABWDMMX-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.39
Rot. Bonds4

About 5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (PubChem CID 53305005) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
PubChem CID53305005
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESO=C1c2cc(-c3ccccc3)nn2CCN1CCCO
InChIInChI=1S/C15H17N3O2/c19-10-4-7-17-8-9-18-14(15(17)20)11-13(16-18)12-5-2-1-3-6-12/h1-3,5-6,11,19H,4,7-10H2
InChIKeyKARKBIOABWDMMX-UHFFFAOYSA-N
XLogP1.39
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (CID 53305005) is 5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is O=C1c2cc(-c3ccccc3)nn2CCN1CCCO.
What is the InChIKey of 5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is KARKBIOABWDMMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c19-10-4-7-17-8-9-18-14(15(17)20)11-13(16-18)12-5-2-1-3-6-12/h1-3,5-6,11,19H,4,7-10H2.
What are the key properties of 5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 271.32 g/mol, XLogP of 1.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-hydroxypropyl)-2-phenyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 53305005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).