4-methyl-1-pyrazin-2-ylpiperazin-2-one

C9H12N4O — CID 21050564

IUPAC4-methyl-1-pyrazin-2-ylpiperazin-2-one
SMILESCN1CCN(c2cnccn2)C(=O)C1
InChIInChI=1S/C9H12N4O/c1-12-4-5-13(9(14)7-12)8-6-10-2-3-11-8/h2-3,6H,4-5,7H2,1H3
InChIKeyPOYDFUHONIFWFR-UHFFFAOYSA-N
MW192.22 g/mol
LogP-0.25
Rot. Bonds1

About 4-methyl-1-pyrazin-2-ylpiperazin-2-one

4-methyl-1-pyrazin-2-ylpiperazin-2-one (PubChem CID 21050564) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is 4-methyl-1-pyrazin-2-ylpiperazin-2-one.

Molecular Properties

Compound Name4-methyl-1-pyrazin-2-ylpiperazin-2-one
PubChem CID21050564
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC Name4-methyl-1-pyrazin-2-ylpiperazin-2-one
SMILESCN1CCN(c2cnccn2)C(=O)C1
InChIInChI=1S/C9H12N4O/c1-12-4-5-13(9(14)7-12)8-6-10-2-3-11-8/h2-3,6H,4-5,7H2,1H3
InChIKeyPOYDFUHONIFWFR-UHFFFAOYSA-N
XLogP-0.25
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 5-0.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-pyrazin-2-ylpiperazin-2-one?
The IUPAC name of 4-methyl-1-pyrazin-2-ylpiperazin-2-one (CID 21050564) is 4-methyl-1-pyrazin-2-ylpiperazin-2-one.
What is the SMILES notation for 4-methyl-1-pyrazin-2-ylpiperazin-2-one?
The canonical SMILES for 4-methyl-1-pyrazin-2-ylpiperazin-2-one is CN1CCN(c2cnccn2)C(=O)C1.
What is the InChIKey of 4-methyl-1-pyrazin-2-ylpiperazin-2-one?
The InChIKey is POYDFUHONIFWFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O/c1-12-4-5-13(9(14)7-12)8-6-10-2-3-11-8/h2-3,6H,4-5,7H2,1H3.
What are the key properties of 4-methyl-1-pyrazin-2-ylpiperazin-2-one?
4-methyl-1-pyrazin-2-ylpiperazin-2-one has a molecular weight of 192.22 g/mol, XLogP of -0.25, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-pyrazin-2-ylpiperazin-2-one is sourced from PubChem (CID 21050564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).