2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

C16H19N3O2 — CID 44589373

IUPAC2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESCOc1ccc(-c2cc3n(n2)CCN(C(C)C)C3=O)cc1
InChIInChI=1S/C16H19N3O2/c1-11(2)18-8-9-19-15(16(18)20)10-14(17-19)12-4-6-13(21-3)7-5-12/h4-7,10-11H,8-9H2,1-3H3
InChIKeyUBJOGRLNDXCSAF-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.42
Rot. Bonds3

About 2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (PubChem CID 44589373) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
PubChem CID44589373
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESCOc1ccc(-c2cc3n(n2)CCN(C(C)C)C3=O)cc1
InChIInChI=1S/C16H19N3O2/c1-11(2)18-8-9-19-15(16(18)20)10-14(17-19)12-4-6-13(21-3)7-5-12/h4-7,10-11H,8-9H2,1-3H3
InChIKeyUBJOGRLNDXCSAF-UHFFFAOYSA-N
XLogP2.42
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(6-chloro-3-pyridinyl)methyl]-2-(4-methoxyphenyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 44589392
2-(4-methoxyphenyl)-5,6-dihydropyrazolo[5,1-a]isoquinoline
CID 12948315
N-[2-(4-ethoxyphenyl)ethyl]-2-[2-(4-methoxyphenyl)-4-oxo-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]acetamide
CID 46344482
2-[4-oxo-2-(4-propan-2-ylphenyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5-yl]acetic acid
CID 53213613
7-(4-chlorophenyl)-2-(4-methoxyphenyl)-5,8-dihydropyrazolo[5,1-d][1,2,5]triazepin-4-one
CID 56956509
2-[3,5-bis(4-methoxyphenyl)pyrazol-1-yl]acetic acid
CID 86762670
(6S)-N-cyclohexyl-2-(4-methoxyphenyl)-6-methyl-4-oxo-5-[(1R)-1-phenylethyl]-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 92738971
1-(2-ethylphenyl)-3,5-bis(4-methoxyphenyl)pyrazole
CID 19587123
1-(4-methoxyphenyl)-3-[4-(2-methylpropyl)phenyl]pyrazole-5-carboxylic acid
CID 91872022
(6S)-N-cyclohexyl-5-cyclopentyl-2-(4-methoxyphenyl)-6-methyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-6-carboxamide
CID 92738963
2-[2-(4-methoxyphenyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl]-N-(1-phenylethyl)acetamide
CID 53050981
ethyl 2-[[2-(4-methoxyphenyl)-5,6-dimethyl-4-oxo-7H-pyrazolo[1,5-a]pyrazine-6-carbonyl]amino]acetate
CID 46272743

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (CID 44589373) is 2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is COc1ccc(-c2cc3n(n2)CCN(C(C)C)C3=O)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is UBJOGRLNDXCSAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-11(2)18-8-9-19-15(16(18)20)10-14(17-19)12-4-6-13(21-3)7-5-12/h4-7,10-11H,8-9H2,1-3H3.
What are the key properties of 2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 285.35 g/mol, XLogP of 2.42, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-propan-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 44589373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).