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

C15H16ClN3O2 — CID 53248825

IUPAC2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESO=C1c2cc(-c3ccc(Cl)cc3)nn2CCN1CCCO
InChIInChI=1S/C15H16ClN3O2/c16-12-4-2-11(3-5-12)13-10-14-15(21)18(6-1-9-20)7-8-19(14)17-13/h2-5,10,20H,1,6-9H2
InChIKeyAYZFYOGOOFVONW-UHFFFAOYSA-N
MW305.76 g/mol
LogP2.04
Rot. Bonds4

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

2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (PubChem CID 53248825) has the molecular formula C15H16ClN3O2 and a molecular weight of 305.76 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
PubChem CID53248825
Molecular FormulaC15H16ClN3O2
Molecular Weight305.76 g/mol
Exact Mass305.09
IUPAC Name2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESO=C1c2cc(-c3ccc(Cl)cc3)nn2CCN1CCCO
InChIInChI=1S/C15H16ClN3O2/c16-12-4-2-11(3-5-12)13-10-14-15(21)18(6-1-9-20)7-8-19(14)17-13/h2-5,10,20H,1,6-9H2
InChIKeyAYZFYOGOOFVONW-UHFFFAOYSA-N
XLogP2.04
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.76
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (CID 53248825) is 2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is O=C1c2cc(-c3ccc(Cl)cc3)nn2CCN1CCCO.
What is the InChIKey of 2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is AYZFYOGOOFVONW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O2/c16-12-4-2-11(3-5-12)13-10-14-15(21)18(6-1-9-20)7-8-19(14)17-13/h2-5,10,20H,1,6-9H2.
What are the key properties of 2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 305.76 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5-(3-hydroxypropyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 53248825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).