1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one

C12H20N4O — CID 53015085

IUPAC1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one
SMILESCCN1CCN(c2nccn(CC)c2=O)CC1
InChIInChI=1S/C12H20N4O/c1-3-14-7-9-16(10-8-14)11-12(17)15(4-2)6-5-13-11/h5-6H,3-4,7-10H2,1-2H3
InChIKeyZIPVZSKXYKATFZ-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.41
Rot. Bonds3

About 1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one

1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one (PubChem CID 53015085) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one.

Molecular Properties

Compound Name1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one
PubChem CID53015085
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one
SMILESCCN1CCN(c2nccn(CC)c2=O)CC1
InChIInChI=1S/C12H20N4O/c1-3-14-7-9-16(10-8-14)11-12(17)15(4-2)6-5-13-11/h5-6H,3-4,7-10H2,1-2H3
InChIKeyZIPVZSKXYKATFZ-UHFFFAOYSA-N
XLogP0.41
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-Ethyl-3-(piperidin-1-YL)-1,2-dihydropyrazin-2-one
CID 53015072
1-Ethyl-3-(4-methylpiperazin-1-YL)-1,2-dihydropyrazin-2-one
CID 53015084
1-Cyclopropyl-3-[4-(2-methylpropyl)-3-oxopiperazin-1-YL]pyrazin-2-one
CID 91650224
1-(2-Methylpropyl)-3-(piperidin-1-YL)-1,2-dihydropyrazin-2-one
CID 53015075
3-(Piperidin-1-YL)-1-propyl-1,2-dihydropyrazin-2-one
CID 53015079
3-(4-Methylpiperazin-1-YL)-1-(2-methylpropyl)-1,2-dihydropyrazin-2-one
CID 53015087
3-(Piperazin-1-yl)-1,2-dihydropyrazin-2-one
CID 56737793
3-(4-Isopropyl-1-piperazinyl)-2(1H)-pyrazinone
CID 69364335
3-(4-Methyl-1-piperazinyl)-2(1H)-pyrazinone
CID 69365795
3-(4-ethylpiperazin-1-yl)-1H-pyrazin-2-one
CID 115650134
3-(4-acetylpiperazin-1-yl)-1H-pyrazin-2-one
CID 115650141
3-(3-oxopiperazin-1-yl)-1H-pyrazin-2-one
CID 115650183

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one?
The IUPAC name of 1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one (CID 53015085) is 1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one.
What is the SMILES notation for 1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one?
The canonical SMILES for 1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one is CCN1CCN(c2nccn(CC)c2=O)CC1.
What is the InChIKey of 1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one?
The InChIKey is ZIPVZSKXYKATFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-3-14-7-9-16(10-8-14)11-12(17)15(4-2)6-5-13-11/h5-6H,3-4,7-10H2,1-2H3.
What are the key properties of 1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one?
1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one has a molecular weight of 236.32 g/mol, XLogP of 0.41, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(4-ethylpiperazin-1-yl)pyrazin-2-one is sourced from PubChem (CID 53015085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).