5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one

C13H19N3O2 — CID 106802608

IUPAC5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
SMILESCCC(O)CCCn1ccn2nc(C)cc2c1=O
InChIInChI=1S/C13H19N3O2/c1-3-11(17)5-4-6-15-7-8-16-12(13(15)18)9-10(2)14-16/h7-9,11,17H,3-6H2,1-2H3
InChIKeyPVOISRSOUKXRDT-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.36
Rot. Bonds5

About 5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one

5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one (PubChem CID 106802608) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
PubChem CID106802608
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
SMILESCCC(O)CCCn1ccn2nc(C)cc2c1=O
InChIInChI=1S/C13H19N3O2/c1-3-11(17)5-4-6-15-7-8-16-12(13(15)18)9-10(2)14-16/h7-9,11,17H,3-6H2,1-2H3
InChIKeyPVOISRSOUKXRDT-UHFFFAOYSA-N
XLogP1.36
TPSA59.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(4-hydroxyhexyl)-2-methylpyrazolo[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

Related Compounds

5-[3-(ethylamino)propyl]-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104734854
5-(5-chloropentyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104734713
2-methyl-5-[4-(propan-2-ylamino)butyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104735472
methyl 4-(2-methyl-4-oxopyrazolo[1,5-a]pyrazin-5-yl)butanoate
CID 104734631
5-(3-azidopropyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104735171
2-methyl-5-[2-(3-methylbutylamino)ethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104735453
5-(2-hydroxy-3,3-dimethylbutyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104735275
3-(2-methyl-4-oxopyrazolo[1,5-a]pyrazin-5-yl)propanenitrile
CID 104734922
5-(2-aminopropyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104734809
2-methyl-5-[3-methyl-2-(methylamino)pentyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104734849
5-[3-(cyclohexylamino)propyl]-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104735476
1-[2-(2-methyl-4-oxopyrazolo[1,5-a]pyrazin-5-yl)ethyl]triazole-4-carboxylic acid
CID 104734629

Frequently Asked Questions

What is the IUPAC name of 5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one (CID 106802608) is 5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one is CCC(O)CCCn1ccn2nc(C)cc2c1=O.
What is the InChIKey of 5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is PVOISRSOUKXRDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-3-11(17)5-4-6-15-7-8-16-12(13(15)18)9-10(2)14-16/h7-9,11,17H,3-6H2,1-2H3.
What are the key properties of 5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one?
5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 249.31 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-hydroxyhexyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 106802608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).