5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one

C23H23N3O4 — CID 56673496

IUPAC5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one
SMILESCOc1ccc(-c2cn3nc(-c4ccccc4)cc3c(=O)n2CCOCCO)cc1
InChIInChI=1S/C23H23N3O4/c1-29-19-9-7-18(8-10-19)22-16-26-21(23(28)25(22)11-13-30-14-12-27)15-20(24-26)17-5-3-2-4-6-17/h2-10,15-16,27H,11-14H2,1H3
InChIKeyGUVDYUIUSGVSKJ-UHFFFAOYSA-N
MW405.45 g/mol
LogP2.85
Rot. Bonds8

About 5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one

5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one (PubChem CID 56673496) has the molecular formula C23H23N3O4 and a molecular weight of 405.45 g/mol. Its IUPAC name is 5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one
PubChem CID56673496
Molecular FormulaC23H23N3O4
Molecular Weight405.45 g/mol
Exact Mass405.17
IUPAC Name5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one
SMILESCOc1ccc(-c2cn3nc(-c4ccccc4)cc3c(=O)n2CCOCCO)cc1
InChIInChI=1S/C23H23N3O4/c1-29-19-9-7-18(8-10-19)22-16-26-21(23(28)25(22)11-13-30-14-12-27)15-20(24-26)17-5-3-2-4-6-17/h2-10,15-16,27H,11-14H2,1H3
InChIKeyGUVDYUIUSGVSKJ-UHFFFAOYSA-N
XLogP2.85
TPSA77.99 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.45
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[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

N-(4-methoxybenzyl)-3-methyl-1-phenyl-1H-pyrazole-5-carboxamide
CID 5015296
2-Methyl-2-[2-methyl-4-[[[1-methyl-5-(4-morpholin-4-ylphenyl)pyrazole-3-carbonyl]amino]methyl]phenoxy]propanoic acid
CID 11237218
2-Methyl-2-[2-methyl-4-[[[1-methyl-5-(4-prop-2-enoxyphenyl)pyrazole-3-carbonyl]amino]methyl]phenoxy]propanoic acid
CID 11259787
2-[4-[[[5-(4-Tert-butylphenyl)-1-(2-methoxyethyl)pyrazole-3-carbonyl]amino]methyl]-2-methylphenoxy]-2-methylpropanoic acid
CID 11306745
2-Methyl-2-[2-methyl-4-[[[1-methyl-5-(4-phenylmethoxyphenyl)pyrazole-3-carbonyl]amino]methyl]phenoxy]propanoic acid
CID 11352791
2-[4-[[[3-(4-Tert-butylphenyl)-1-methylpyrazole-5-carbonyl]amino]methyl]phenoxy]-2-methylpropanoic acid
CID 11374318
2-[4-[[[3-(4-Tert-butylphenyl)-1-(2-methoxyethyl)pyrazole-5-carbonyl]amino]methyl]-2-methylphenoxy]-2-methylpropanoic acid
CID 11432162
Ethyl 1-benzyl-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxylate
CID 15991002
5-(4-fluorophenyl)-2-(p-tolyloxymethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
CID 57410027
5-(4-Methylphenyl)-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 67973913
Methyl 5-(4-methoxybenzyl)-4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
CID 1475683
2-[2-(4-ethoxyphenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]-N-(4-methoxybenzyl)acetamide
CID 16028260

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one (CID 56673496) is 5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one is COc1ccc(-c2cn3nc(-c4ccccc4)cc3c(=O)n2CCOCCO)cc1.
What is the InChIKey of 5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is GUVDYUIUSGVSKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O4/c1-29-19-9-7-18(8-10-19)22-16-26-21(23(28)25(22)11-13-30-14-12-27)15-20(24-26)17-5-3-2-4-6-17/h2-10,15-16,27H,11-14H2,1H3.
What are the key properties of 5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one?
5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 405.45 g/mol, XLogP of 2.85, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-hydroxyethoxy)ethyl]-6-(4-methoxyphenyl)-2-phenylpyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 56673496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).