3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one

C10H16N4O — CID 79300366

IUPAC3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one
SMILESCCc1nn(C)c2c1NC(=O)C(C)N2C
InChIInChI=1S/C10H16N4O/c1-5-7-8-10(14(4)12-7)13(3)6(2)9(15)11-8/h6H,5H2,1-4H3,(H,11,15)
InChIKeyJONLLTVQWBAJSV-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.76
Rot. Bonds1

About 3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one

3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one (PubChem CID 79300366) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one.

Molecular Properties

Compound Name3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one
PubChem CID79300366
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one
SMILESCCc1nn(C)c2c1NC(=O)C(C)N2C
InChIInChI=1S/C10H16N4O/c1-5-7-8-10(14(4)12-7)13(3)6(2)9(15)11-8/h6H,5H2,1-4H3,(H,11,15)
InChIKeyJONLLTVQWBAJSV-UHFFFAOYSA-N
XLogP0.76
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,3-dimethyl-5-piperazin-1-ylpyrazol-4-yl)butanamide
CID 172436165
1,3-Dimethyl-7-(2,2,2-trifluoroethyl)-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one
CID 79288558
3-Ethyl-1-methyl-7-(2,2,2-trifluoroethyl)-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one
CID 79300369
1-Methyl-3-propyl-7-(2,2,2-trifluoroethyl)-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one
CID 79305243
1-Ethyl-3-methyl-7-(2,2,2-trifluoroethyl)-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one
CID 79307742
1-Ethyl-3,6-dimethyl-6-(trifluoromethyl)-4,7-dihydropyrazolo[4,5-b]pyrazin-5-one
CID 136288843
1,6-Dimethyl-3-propyl-6-(trifluoromethyl)-4,7-dihydropyrazolo[4,5-b]pyrazin-5-one
CID 136288850
3-Ethyl-1,6-dimethyl-6-(trifluoromethyl)-4,7-dihydropyrazolo[4,5-b]pyrazin-5-one
CID 136288860
1-(1-ethyl-propyl)-3-methyl-6-methylamino-1H-pyrazolo[3,4-b]pyrazin-5-ol
CID 59995700
2-N-[2-(dimethylamino)ethyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-2,3-diamine
CID 89641981
2-[(3-Amino-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-ethyl-dimethylazanium
CID 89642009
3-[(3-Amino-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)amino]propyl-trimethylazanium
CID 89642010

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one?
The IUPAC name of 3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one (CID 79300366) is 3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one.
What is the SMILES notation for 3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one?
The canonical SMILES for 3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one is CCc1nn(C)c2c1NC(=O)C(C)N2C.
What is the InChIKey of 3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one?
The InChIKey is JONLLTVQWBAJSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-5-7-8-10(14(4)12-7)13(3)6(2)9(15)11-8/h6H,5H2,1-4H3,(H,11,15).
What are the key properties of 3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one?
3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one has a molecular weight of 208.26 g/mol, XLogP of 0.76, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1,6,7-trimethyl-4,6-dihydropyrazolo[4,5-b]pyrazin-5-one is sourced from PubChem (CID 79300366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).