3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one

C9H10N4O — CID 103571127

IUPAC3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one
SMILESCCn1cc(-c2ncc[nH]c2=O)cn1
InChIInChI=1S/C9H10N4O/c1-2-13-6-7(5-12-13)8-9(14)11-4-3-10-8/h3-6H,2H2,1H3,(H,11,14)
InChIKeyYEPIIRHQRLVYAV-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.65
Rot. Bonds2

About 3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one

3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one (PubChem CID 103571127) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one.

Molecular Properties

Compound Name3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one
PubChem CID103571127
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one
SMILESCCn1cc(-c2ncc[nH]c2=O)cn1
InChIInChI=1S/C9H10N4O/c1-2-13-6-7(5-12-13)8-9(14)11-4-3-10-8/h3-6H,2H2,1H3,(H,11,14)
InChIKeyYEPIIRHQRLVYAV-UHFFFAOYSA-N
XLogP0.65
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(1-ethylpyrazol-4-yl)pyrazin-2-yl]hydrazine
CID 103571128
6-(1-ethylpyrazol-4-yl)-5-methyl-1H-pyrimidin-2-one
CID 106515932
4-(1-ethylpyrazol-4-yl)-1,3-thiazol-5-amine
CID 103570447
2-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyrimidine
CID 115403490
1-ethyl-4-(1H-imidazol-5-yl)pyrazole;hydrochloride
CID 67500295
4-(1-ethylpyrazol-4-yl)-2-imidazol-1-yl-5-propan-2-yl-1H-pyrimidin-6-one
CID 138597012
3-(5-methylthiophen-3-yl)-1H-pyrazin-2-one
CID 106518527
3-(3-methylphenyl)-1H-pyrazin-2-one
CID 112558965
2-(1-ethylpyrazol-4-yl)-N-methylpyrimidin-4-amine
CID 103570484
5-bromo-2-(1-ethylpyrazol-4-yl)-4-phenyl-1H-pyrimidin-6-one
CID 136677135
3-(1-ethylpyrazol-4-yl)-1H-imidazol-2-one
CID 103125244
2-(1-ethylpyrazol-4-yl)-4-fluoropyridine
CID 102824444

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one?
The IUPAC name of 3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one (CID 103571127) is 3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one.
What is the SMILES notation for 3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one?
The canonical SMILES for 3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one is CCn1cc(-c2ncc[nH]c2=O)cn1.
What is the InChIKey of 3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one?
The InChIKey is YEPIIRHQRLVYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-2-13-6-7(5-12-13)8-9(14)11-4-3-10-8/h3-6H,2H2,1H3,(H,11,14).
What are the key properties of 3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one?
3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one has a molecular weight of 190.21 g/mol, XLogP of 0.65, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethylpyrazol-4-yl)-1H-pyrazin-2-one is sourced from PubChem (CID 103571127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).