2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one

C9H9N3O2 — CID 90362861

IUPAC2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one
SMILESCOc1nc2cccnc2n(C)c1=O
InChIInChI=1S/C9H9N3O2/c1-12-7-6(4-3-5-10-7)11-8(14-2)9(12)13/h3-5H,1-2H3
InChIKeyULHRDBJDJNOQBZ-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.34
Rot. Bonds1

About 2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one

2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one (PubChem CID 90362861) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is 2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one.

Molecular Properties

Compound Name2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one
PubChem CID90362861
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one
SMILESCOc1nc2cccnc2n(C)c1=O
InChIInChI=1S/C9H9N3O2/c1-12-7-6(4-3-5-10-7)11-8(14-2)9(12)13/h3-5H,1-2H3
InChIKeyULHRDBJDJNOQBZ-UHFFFAOYSA-N
XLogP0.34
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one?
The IUPAC name of 2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one (CID 90362861) is 2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one.
What is the SMILES notation for 2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one?
The canonical SMILES for 2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one is COc1nc2cccnc2n(C)c1=O.
What is the InChIKey of 2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one?
The InChIKey is ULHRDBJDJNOQBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c1-12-7-6(4-3-5-10-7)11-8(14-2)9(12)13/h3-5H,1-2H3.
What are the key properties of 2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one?
2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one has a molecular weight of 191.19 g/mol, XLogP of 0.34, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-methylpyrido[2,3-b]pyrazin-3-one is sourced from PubChem (CID 90362861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).