2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine

C12H14N6 — CID 2458984

IUPAC2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine
SMILESc1cnc(N2CCN(c3cnccn3)CC2)nc1
InChIInChI=1S/C12H14N6/c1-2-15-12(16-3-1)18-8-6-17(7-9-18)11-10-13-4-5-14-11/h1-5,10H,6-9H2
InChIKeyZHRRMTBJVSOJRB-UHFFFAOYSA-N
MW242.29 g/mol
LogP0.59
Rot. Bonds2

About 2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine

2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine (PubChem CID 2458984) has the molecular formula C12H14N6 and a molecular weight of 242.29 g/mol. Its IUPAC name is 2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine.

Molecular Properties

Compound Name2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine
PubChem CID2458984
Molecular FormulaC12H14N6
Molecular Weight242.29 g/mol
Exact Mass242.13
IUPAC Name2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine
SMILESc1cnc(N2CCN(c3cnccn3)CC2)nc1
InChIInChI=1S/C12H14N6/c1-2-15-12(16-3-1)18-8-6-17(7-9-18)11-10-13-4-5-14-11/h1-5,10H,6-9H2
InChIKeyZHRRMTBJVSOJRB-UHFFFAOYSA-N
XLogP0.59
TPSA58.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.29
LogP ≤ 50.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine?
The IUPAC name of 2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine (CID 2458984) is 2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine.
What is the SMILES notation for 2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine?
The canonical SMILES for 2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine is c1cnc(N2CCN(c3cnccn3)CC2)nc1.
What is the InChIKey of 2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine?
The InChIKey is ZHRRMTBJVSOJRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6/c1-2-15-12(16-3-1)18-8-6-17(7-9-18)11-10-13-4-5-14-11/h1-5,10H,6-9H2.
What are the key properties of 2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine?
2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine has a molecular weight of 242.29 g/mol, XLogP of 0.59, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-pyrazin-2-ylpiperazin-1-yl)pyrimidine is sourced from PubChem (CID 2458984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).