5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one

C15H13N3O3 — CID 104735022

IUPAC5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one
SMILESCOc1ccccc1C(=O)Cn1ccn2nccc2c1=O
InChIInChI=1S/C15H13N3O3/c1-21-14-5-3-2-4-11(14)13(19)10-17-8-9-18-12(15(17)20)6-7-16-18/h2-9H,10H2,1H3
InChIKeyCCKNQYYJAYRDBX-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.39
Rot. Bonds4

About 5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one

5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one (PubChem CID 104735022) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is 5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one
PubChem CID104735022
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC Name5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one
SMILESCOc1ccccc1C(=O)Cn1ccn2nccc2c1=O
InChIInChI=1S/C15H13N3O3/c1-21-14-5-3-2-4-11(14)13(19)10-17-8-9-18-12(15(17)20)6-7-16-18/h2-9H,10H2,1H3
InChIKeyCCKNQYYJAYRDBX-UHFFFAOYSA-N
XLogP1.39
TPSA65.60 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-[2-(3,4-dimethylphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one
CID 104735025
1-(2-methoxyphenyl)-2-(triazol-1-yl)ethanone
CID 178069289
2-indazol-1-yl-1-(2-methoxyphenyl)ethanone
CID 62140573
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
(Z)-2-methyl-4-(4-oxopyrazolo[1,5-a]pyrazin-5-yl)but-2-enoic acid
CID 104734602
5-ethyl-1-[2-(2-methoxyphenyl)-2-oxoethyl]pyrimidine-2,4-dione
CID 66330111
5-butylpyrazolo[1,5-a]pyrazin-4-one
CID 154883945
1-[2-(2-methoxyphenyl)-2-oxoethyl]-6-methylpyridin-2-one
CID 62024011
2,2-dimethyl-4-(4-oxopyrazolo[1,5-a]pyrazin-5-yl)butanoic acid
CID 113446806
(E)-4-(4-oxopyrazolo[1,5-a]pyrazin-5-yl)but-2-enoic acid
CID 104734580
1-[2-(2-ethoxyphenyl)-2-oxoethyl]-3-propylimidazol-2-one
CID 80580045
N-[(3,5-dimethoxyphenyl)methyl]-3-(4-oxopyrazolo[1,5-a]pyrazin-5-yl)propanamide
CID 155977066

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one (CID 104735022) is 5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one is COc1ccccc1C(=O)Cn1ccn2nccc2c1=O.
What is the InChIKey of 5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is CCKNQYYJAYRDBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3/c1-21-14-5-3-2-4-11(14)13(19)10-17-8-9-18-12(15(17)20)6-7-16-18/h2-9H,10H2,1H3.
What are the key properties of 5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one?
5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 283.29 g/mol, XLogP of 1.39, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-methoxyphenyl)-2-oxoethyl]pyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 104735022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).