2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one

C9H9N3O3 — CID 176774328

IUPAC2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one
SMILESCOc1nc2cc[nH]c(=O)c2nc1OC
InChIInChI=1S/C9H9N3O3/c1-14-8-9(15-2)12-6-5(11-8)3-4-10-7(6)13/h3-4H,1-2H3,(H,10,13)
InChIKeyDGFYBJGNBMCJAI-UHFFFAOYSA-N
MW207.19 g/mol
LogP0.34
Rot. Bonds2

About 2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one

2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one (PubChem CID 176774328) has the molecular formula C9H9N3O3 and a molecular weight of 207.19 g/mol. Its IUPAC name is 2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one.

Molecular Properties

Compound Name2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one
PubChem CID176774328
Molecular FormulaC9H9N3O3
Molecular Weight207.19 g/mol
Exact Mass207.06
IUPAC Name2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one
SMILESCOc1nc2cc[nH]c(=O)c2nc1OC
InChIInChI=1S/C9H9N3O3/c1-14-8-9(15-2)12-6-5(11-8)3-4-10-7(6)13/h3-4H,1-2H3,(H,10,13)
InChIKeyDGFYBJGNBMCJAI-UHFFFAOYSA-N
XLogP0.34
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.19
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one?
The IUPAC name of 2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one (CID 176774328) is 2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one.
What is the SMILES notation for 2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one?
The canonical SMILES for 2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one is COc1nc2cc[nH]c(=O)c2nc1OC.
What is the InChIKey of 2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one?
The InChIKey is DGFYBJGNBMCJAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O3/c1-14-8-9(15-2)12-6-5(11-8)3-4-10-7(6)13/h3-4H,1-2H3,(H,10,13).
What are the key properties of 2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one?
2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one has a molecular weight of 207.19 g/mol, XLogP of 0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one is sourced from PubChem (CID 176774328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).