4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione

C8H8N2O3 — CID 134540820

IUPAC4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione
SMILESO=C1NCC(O)n2c1cccc2=O
InChIInChI=1S/C8H8N2O3/c11-6-3-1-2-5-8(13)9-4-7(12)10(5)6/h1-3,7,12H,4H2,(H,9,13)
InChIKeyGMKOYLJAQDZOEE-UHFFFAOYSA-N
MW180.16 g/mol
LogP-0.92
Rot. Bonds

About 4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione

4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione (PubChem CID 134540820) has the molecular formula C8H8N2O3 and a molecular weight of 180.16 g/mol. Its IUPAC name is 4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione.

Molecular Properties

Compound Name4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione
PubChem CID134540820
Molecular FormulaC8H8N2O3
Molecular Weight180.16 g/mol
Exact Mass180.05
IUPAC Name4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione
SMILESO=C1NCC(O)n2c1cccc2=O
InChIInChI=1S/C8H8N2O3/c11-6-3-1-2-5-8(13)9-4-7(12)10(5)6/h1-3,7,12H,4H2,(H,9,13)
InChIKeyGMKOYLJAQDZOEE-UHFFFAOYSA-N
XLogP-0.92
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.16
LogP ≤ 5-0.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione?
The IUPAC name of 4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione (CID 134540820) is 4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione.
What is the SMILES notation for 4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione?
The canonical SMILES for 4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione is O=C1NCC(O)n2c1cccc2=O.
What is the InChIKey of 4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione?
The InChIKey is GMKOYLJAQDZOEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O3/c11-6-3-1-2-5-8(13)9-4-7(12)10(5)6/h1-3,7,12H,4H2,(H,9,13).
What are the key properties of 4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione?
4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione has a molecular weight of 180.16 g/mol, XLogP of -0.92, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione is sourced from PubChem (CID 134540820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).