3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione

C7H7N3O2 — CID 90280041

IUPAC3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione
SMILESO=C1NCCn2cnc(=O)cc21
InChIInChI=1S/C7H7N3O2/c11-6-3-5-7(12)8-1-2-10(5)4-9-6/h3-4H,1-2H2,(H,8,12)
InChIKeyDIJRQXWCLGVDIS-UHFFFAOYSA-N
MW165.15 g/mol
LogP-1.01
Rot. Bonds

About 3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione

3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione (PubChem CID 90280041) has the molecular formula C7H7N3O2 and a molecular weight of 165.15 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione.

Molecular Properties

Compound Name3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione
PubChem CID90280041
Molecular FormulaC7H7N3O2
Molecular Weight165.15 g/mol
Exact Mass165.05
IUPAC Name3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione
SMILESO=C1NCCn2cnc(=O)cc21
InChIInChI=1S/C7H7N3O2/c11-6-3-5-7(12)8-1-2-10(5)4-9-6/h3-4H,1-2H2,(H,8,12)
InChIKeyDIJRQXWCLGVDIS-UHFFFAOYSA-N
XLogP-1.01
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.15
LogP ≤ 5-1.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione?
The IUPAC name of 3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione (CID 90280041) is 3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione.
What is the SMILES notation for 3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione?
The canonical SMILES for 3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione is O=C1NCCn2cnc(=O)cc21.
What is the InChIKey of 3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione?
The InChIKey is DIJRQXWCLGVDIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2/c11-6-3-5-7(12)8-1-2-10(5)4-9-6/h3-4H,1-2H2,(H,8,12).
What are the key properties of 3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione?
3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione has a molecular weight of 165.15 g/mol, XLogP of -1.01, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyrazino[1,2-c]pyrimidine-1,8-dione is sourced from PubChem (CID 90280041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).