5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

C20H20N8O — CID 146043158

IUPAC5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESCc1cccc(-n2nc(-c3cn[nH]c3C)nc2-c2cc3n(n2)CCN(C)C3=O)c1
InChIInChI=1S/C20H20N8O/c1-12-5-4-6-14(9-12)28-19(22-18(25-28)15-11-21-23-13(15)2)16-10-17-20(29)26(3)7-8-27(17)24-16/h4-6,9-11H,7-8H2,1-3H3,(H,21,23)
InChIKeyQVQKLFZZJILSFP-UHFFFAOYSA-N
MW388.44 g/mol
LogP2.22
Rot. Bonds3

About 5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (PubChem CID 146043158) has the molecular formula C20H20N8O and a molecular weight of 388.44 g/mol. Its IUPAC name is 5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
PubChem CID146043158
Molecular FormulaC20H20N8O
Molecular Weight388.44 g/mol
Exact Mass388.18
IUPAC Name5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESCc1cccc(-n2nc(-c3cn[nH]c3C)nc2-c2cc3n(n2)CCN(C)C3=O)c1
InChIInChI=1S/C20H20N8O/c1-12-5-4-6-14(9-12)28-19(22-18(25-28)15-11-21-23-13(15)2)16-10-17-20(29)26(3)7-8-27(17)24-16/h4-6,9-11H,7-8H2,1-3H3,(H,21,23)
InChIKeyQVQKLFZZJILSFP-UHFFFAOYSA-N
XLogP2.22
TPSA97.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.44
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-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

Related Compounds

2-(2-tert-butyl-5-phenyl-1,2,4-triazol-3-yl)-5-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 146039624
2-[2-(3-methylphenyl)pyrimidin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
CID 59723271
2-[2-[(2-chlorophenyl)methyl]-5-ethyl-1,2,4-triazol-3-yl]-5-methyl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 146046205
1-(3-methylphenyl)-5-phenyl-3-(3-phenylphenyl)-1,2,4-triazole
CID 130289066
3-(4-fluorophenyl)-1-(3-methylphenyl)pyrazole-5-carboxylic acid
CID 812159
1-(3-methylphenyl)-3-pyridin-2-ylpyrazole-5-carboxylic acid
CID 82370949
1-(3-methylphenyl)-3-pyridin-3-ylpyrazole-5-carboxylic acid
CID 2381730
2-(5-methyl-1H-pyrazol-4-yl)-[1,2,4]triazolo[1,5-c]quinazoline
CID 175889940
1-(3-chloro-4-methylphenyl)-3,5-bis(3-methylphenyl)pyrazole
CID 19587265
5-amino-4-(3-methylphenyl)-1H-pyridazin-6-one
CID 117127405
5-iodo-2-(3-methylphenyl)pyridazin-3-one
CID 24997710
1,5-bis(3-methylphenyl)-1,2,4-triazole-3-carboxamide
CID 13292301

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (CID 146043158) is 5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is Cc1cccc(-n2nc(-c3cn[nH]c3C)nc2-c2cc3n(n2)CCN(C)C3=O)c1.
What is the InChIKey of 5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is QVQKLFZZJILSFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N8O/c1-12-5-4-6-14(9-12)28-19(22-18(25-28)15-11-21-23-13(15)2)16-10-17-20(29)26(3)7-8-27(17)24-16/h4-6,9-11H,7-8H2,1-3H3,(H,21,23).
What are the key properties of 5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 388.44 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[2-(3-methylphenyl)-5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-triazol-3-yl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 146043158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).