6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine

C7H11N3 — CID 175635245

IUPAC6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine
SMILESC1=CN=C2CNCCN2C1
InChIInChI=1S/C7H11N3/c1-2-9-7-6-8-3-5-10(7)4-1/h1-2,8H,3-6H2
InChIKeyVTTHHLQWWJYTHE-UHFFFAOYSA-N
MW137.19 g/mol
LogP-0.18
Rot. Bonds

About 6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine

6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine (PubChem CID 175635245) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine.

Molecular Properties

Compound Name6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine
PubChem CID175635245
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine
SMILESC1=CN=C2CNCCN2C1
InChIInChI=1S/C7H11N3/c1-2-9-7-6-8-3-5-10(7)4-1/h1-2,8H,3-6H2
InChIKeyVTTHHLQWWJYTHE-UHFFFAOYSA-N
XLogP-0.18
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine?
The IUPAC name of 6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine (CID 175635245) is 6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine.
What is the SMILES notation for 6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine?
The canonical SMILES for 6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine is C1=CN=C2CNCCN2C1.
What is the InChIKey of 6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine?
The InChIKey is VTTHHLQWWJYTHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c1-2-9-7-6-8-3-5-10(7)4-1/h1-2,8H,3-6H2.
What are the key properties of 6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine?
6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine has a molecular weight of 137.19 g/mol, XLogP of -0.18, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7,8,9-tetrahydro-4H-pyrazino[1,2-a]pyrimidine is sourced from PubChem (CID 175635245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).