1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one

C11H18N4O — CID 62929015

IUPAC1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one
SMILESCCn1ccnc(N2CCNCC2C)c1=O
InChIInChI=1S/C11H18N4O/c1-3-14-6-5-13-10(11(14)16)15-7-4-12-8-9(15)2/h5-6,9,12H,3-4,7-8H2,1-2H3
InChIKeyUIFGELCIEPZBRG-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.06
Rot. Bonds2

About 1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one

1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one (PubChem CID 62929015) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one.

Molecular Properties

Compound Name1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one
PubChem CID62929015
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one
SMILESCCn1ccnc(N2CCNCC2C)c1=O
InChIInChI=1S/C11H18N4O/c1-3-14-6-5-13-10(11(14)16)15-7-4-12-8-9(15)2/h5-6,9,12H,3-4,7-8H2,1-2H3
InChIKeyUIFGELCIEPZBRG-UHFFFAOYSA-N
XLogP0.06
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one?
The IUPAC name of 1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one (CID 62929015) is 1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one.
What is the SMILES notation for 1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one?
The canonical SMILES for 1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one is CCn1ccnc(N2CCNCC2C)c1=O.
What is the InChIKey of 1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one?
The InChIKey is UIFGELCIEPZBRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-3-14-6-5-13-10(11(14)16)15-7-4-12-8-9(15)2/h5-6,9,12H,3-4,7-8H2,1-2H3.
What are the key properties of 1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one?
1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one has a molecular weight of 222.29 g/mol, XLogP of 0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(2-methylpiperazin-1-yl)pyrazin-2-one is sourced from PubChem (CID 62929015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).