2-piperazin-1-ylpyrazine

C8H12N4 — CID 2734639

IUPAC2-piperazin-1-ylpyrazine
SMILESc1cnc(N2CCNCC2)cn1
InChIInChI=1S/C8H12N4/c1-2-11-8(7-10-1)12-5-3-9-4-6-12/h1-2,7,9H,3-6H2
InChIKeyHCGFLVDMFDHYJD-UHFFFAOYSA-N
MW164.21 g/mol
LogP-0.11
Rot. Bonds1

About 2-piperazin-1-ylpyrazine

2-piperazin-1-ylpyrazine (PubChem CID 2734639) has the molecular formula C8H12N4 and a molecular weight of 164.21 g/mol. Its IUPAC name is 2-piperazin-1-ylpyrazine.

Molecular Properties

Compound Name2-piperazin-1-ylpyrazine
PubChem CID2734639
Molecular FormulaC8H12N4
Molecular Weight164.21 g/mol
Exact Mass164.11
IUPAC Name2-piperazin-1-ylpyrazine
SMILESc1cnc(N2CCNCC2)cn1
InChIInChI=1S/C8H12N4/c1-2-11-8(7-10-1)12-5-3-9-4-6-12/h1-2,7,9H,3-6H2
InChIKeyHCGFLVDMFDHYJD-UHFFFAOYSA-N
XLogP-0.11
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-ylpyrazine?
The IUPAC name of 2-piperazin-1-ylpyrazine (CID 2734639) is 2-piperazin-1-ylpyrazine.
What is the SMILES notation for 2-piperazin-1-ylpyrazine?
The canonical SMILES for 2-piperazin-1-ylpyrazine is c1cnc(N2CCNCC2)cn1.
What is the InChIKey of 2-piperazin-1-ylpyrazine?
The InChIKey is HCGFLVDMFDHYJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4/c1-2-11-8(7-10-1)12-5-3-9-4-6-12/h1-2,7,9H,3-6H2.
What are the key properties of 2-piperazin-1-ylpyrazine?
2-piperazin-1-ylpyrazine has a molecular weight of 164.21 g/mol, XLogP of -0.11, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-ylpyrazine is sourced from PubChem (CID 2734639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).