2-methylpyrido[1,2-a]pyrazine-1,6-dione

C9H8N2O2 — CID 134555109

IUPAC2-methylpyrido[1,2-a]pyrazine-1,6-dione
SMILESCn1ccn2c(=O)cccc2c1=O
InChIInChI=1S/C9H8N2O2/c1-10-5-6-11-7(9(10)13)3-2-4-8(11)12/h2-6H,1H3
InChIKeyUTKJJZFOUCRODE-UHFFFAOYSA-N
MW176.17 g/mol
LogP-0.00
Rot. Bonds

About 2-methylpyrido[1,2-a]pyrazine-1,6-dione

2-methylpyrido[1,2-a]pyrazine-1,6-dione (PubChem CID 134555109) has the molecular formula C9H8N2O2 and a molecular weight of 176.17 g/mol. Its IUPAC name is 2-methylpyrido[1,2-a]pyrazine-1,6-dione.

Molecular Properties

Compound Name2-methylpyrido[1,2-a]pyrazine-1,6-dione
PubChem CID134555109
Molecular FormulaC9H8N2O2
Molecular Weight176.17 g/mol
Exact Mass176.06
IUPAC Name2-methylpyrido[1,2-a]pyrazine-1,6-dione
SMILESCn1ccn2c(=O)cccc2c1=O
InChIInChI=1S/C9H8N2O2/c1-10-5-6-11-7(9(10)13)3-2-4-8(11)12/h2-6H,1H3
InChIKeyUTKJJZFOUCRODE-UHFFFAOYSA-N
XLogP-0.00
TPSA43.48 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.17
LogP ≤ 5-0.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methylpyrido[1,2-a]pyrazine-1,6-dione?
The IUPAC name of 2-methylpyrido[1,2-a]pyrazine-1,6-dione (CID 134555109) is 2-methylpyrido[1,2-a]pyrazine-1,6-dione.
What is the SMILES notation for 2-methylpyrido[1,2-a]pyrazine-1,6-dione?
The canonical SMILES for 2-methylpyrido[1,2-a]pyrazine-1,6-dione is Cn1ccn2c(=O)cccc2c1=O.
What is the InChIKey of 2-methylpyrido[1,2-a]pyrazine-1,6-dione?
The InChIKey is UTKJJZFOUCRODE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2/c1-10-5-6-11-7(9(10)13)3-2-4-8(11)12/h2-6H,1H3.
What are the key properties of 2-methylpyrido[1,2-a]pyrazine-1,6-dione?
2-methylpyrido[1,2-a]pyrazine-1,6-dione has a molecular weight of 176.17 g/mol, XLogP of -0.00, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpyrido[1,2-a]pyrazine-1,6-dione is sourced from PubChem (CID 134555109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).