1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone

C11H16N4O — CID 134337079

IUPAC1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone
SMILESCN1CCN(C(=O)Cc2cnccn2)CC1
InChIInChI=1S/C11H16N4O/c1-14-4-6-15(7-5-14)11(16)8-10-9-12-2-3-13-10/h2-3,9H,4-8H2,1H3
InChIKeyUZNWYWXTDCOQJE-UHFFFAOYSA-N
MW220.28 g/mol
LogP-0.21
Rot. Bonds2

About 1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone

1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone (PubChem CID 134337079) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone.

Molecular Properties

Compound Name1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone
PubChem CID134337079
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone
SMILESCN1CCN(C(=O)Cc2cnccn2)CC1
InChIInChI=1S/C11H16N4O/c1-14-4-6-15(7-5-14)11(16)8-10-9-12-2-3-13-10/h2-3,9H,4-8H2,1H3
InChIKeyUZNWYWXTDCOQJE-UHFFFAOYSA-N
XLogP-0.21
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 5-0.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone?
The IUPAC name of 1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone (CID 134337079) is 1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone.
What is the SMILES notation for 1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone?
The canonical SMILES for 1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone is CN1CCN(C(=O)Cc2cnccn2)CC1.
What is the InChIKey of 1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone?
The InChIKey is UZNWYWXTDCOQJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-14-4-6-15(7-5-14)11(16)8-10-9-12-2-3-13-10/h2-3,9H,4-8H2,1H3.
What are the key properties of 1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone?
1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone has a molecular weight of 220.28 g/mol, XLogP of -0.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpiperazin-1-yl)-2-pyrazin-2-ylethanone is sourced from PubChem (CID 134337079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).