3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one

C8H9N3O — CID 10397118

IUPAC3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one
SMILESCC1Nc2ncccc2NC1=O
InChIInChI=1S/C8H9N3O/c1-5-8(12)11-6-3-2-4-9-7(6)10-5/h2-5H,1H3,(H,9,10)(H,11,12)
InChIKeyRJOLRYKVHJWYEN-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.83
Rot. Bonds

About 3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one

3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one (PubChem CID 10397118) has the molecular formula C8H9N3O and a molecular weight of 163.18 g/mol. Its IUPAC name is 3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one.

Molecular Properties

Compound Name3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one
PubChem CID10397118
Molecular FormulaC8H9N3O
Molecular Weight163.18 g/mol
Exact Mass163.07
IUPAC Name3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one
SMILESCC1Nc2ncccc2NC1=O
InChIInChI=1S/C8H9N3O/c1-5-8(12)11-6-3-2-4-9-7(6)10-5/h2-5H,1H3,(H,9,10)(H,11,12)
InChIKeyRJOLRYKVHJWYEN-UHFFFAOYSA-N
XLogP0.83
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one?
The IUPAC name of 3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one (CID 10397118) is 3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one.
What is the SMILES notation for 3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one?
The canonical SMILES for 3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one is CC1Nc2ncccc2NC1=O.
What is the InChIKey of 3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one?
The InChIKey is RJOLRYKVHJWYEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O/c1-5-8(12)11-6-3-2-4-9-7(6)10-5/h2-5H,1H3,(H,9,10)(H,11,12).
What are the key properties of 3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one?
3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one has a molecular weight of 163.18 g/mol, XLogP of 0.83, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one is sourced from PubChem (CID 10397118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).