6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine

C7H9N3 — CID 45087621

IUPAC6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine
SMILESC1=CN2CCN=CC2=NC1
InChIInChI=1S/C7H9N3/c1-2-9-7-6-8-3-5-10(7)4-1/h1,4,6H,2-3,5H2
InChIKeyXPCJOPHZGYWBMY-UHFFFAOYSA-N
MW135.17 g/mol
LogP0.30
Rot. Bonds

About 6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine

6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine (PubChem CID 45087621) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine.

Molecular Properties

Compound Name6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine
PubChem CID45087621
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine
SMILESC1=CN2CCN=CC2=NC1
InChIInChI=1S/C7H9N3/c1-2-9-7-6-8-3-5-10(7)4-1/h1,4,6H,2-3,5H2
InChIKeyXPCJOPHZGYWBMY-UHFFFAOYSA-N
XLogP0.30
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine?
The IUPAC name of 6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine (CID 45087621) is 6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine.
What is the SMILES notation for 6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine?
The canonical SMILES for 6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine is C1=CN2CCN=CC2=NC1.
What is the InChIKey of 6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine?
The InChIKey is XPCJOPHZGYWBMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c1-2-9-7-6-8-3-5-10(7)4-1/h1,4,6H,2-3,5H2.
What are the key properties of 6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine?
6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine has a molecular weight of 135.17 g/mol, XLogP of 0.30, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-2H-pyrazino[1,2-a]pyrimidine is sourced from PubChem (CID 45087621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).