1-piperazin-1-yl-2-pyrazin-2-ylethanone

C10H14N4O — CID 58347533

IUPAC1-piperazin-1-yl-2-pyrazin-2-ylethanone
SMILESO=C(Cc1cnccn1)N1CCNCC1
InChIInChI=1S/C10H14N4O/c15-10(14-5-3-11-4-6-14)7-9-8-12-1-2-13-9/h1-2,8,11H,3-7H2
InChIKeyWJWITPFZQNQQNE-UHFFFAOYSA-N
MW206.25 g/mol
LogP-0.55
Rot. Bonds2

About 1-piperazin-1-yl-2-pyrazin-2-ylethanone

1-piperazin-1-yl-2-pyrazin-2-ylethanone (PubChem CID 58347533) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 1-piperazin-1-yl-2-pyrazin-2-ylethanone.

Molecular Properties

Compound Name1-piperazin-1-yl-2-pyrazin-2-ylethanone
PubChem CID58347533
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name1-piperazin-1-yl-2-pyrazin-2-ylethanone
SMILESO=C(Cc1cnccn1)N1CCNCC1
InChIInChI=1S/C10H14N4O/c15-10(14-5-3-11-4-6-14)7-9-8-12-1-2-13-9/h1-2,8,11H,3-7H2
InChIKeyWJWITPFZQNQQNE-UHFFFAOYSA-N
XLogP-0.55
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-piperazin-1-yl-2-pyrazin-2-ylethanone?
The IUPAC name of 1-piperazin-1-yl-2-pyrazin-2-ylethanone (CID 58347533) is 1-piperazin-1-yl-2-pyrazin-2-ylethanone.
What is the SMILES notation for 1-piperazin-1-yl-2-pyrazin-2-ylethanone?
The canonical SMILES for 1-piperazin-1-yl-2-pyrazin-2-ylethanone is O=C(Cc1cnccn1)N1CCNCC1.
What is the InChIKey of 1-piperazin-1-yl-2-pyrazin-2-ylethanone?
The InChIKey is WJWITPFZQNQQNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c15-10(14-5-3-11-4-6-14)7-9-8-12-1-2-13-9/h1-2,8,11H,3-7H2.
What are the key properties of 1-piperazin-1-yl-2-pyrazin-2-ylethanone?
1-piperazin-1-yl-2-pyrazin-2-ylethanone has a molecular weight of 206.25 g/mol, XLogP of -0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperazin-1-yl-2-pyrazin-2-ylethanone is sourced from PubChem (CID 58347533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).