5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one

C19H22N4O3 — CID 22052202

IUPAC5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one
SMILESCOCC(C)n1c(=O)c(C)nc2c(-c3ccc(OC)nc3C)nccc21
InChIInChI=1S/C19H22N4O3/c1-11(10-25-4)23-15-8-9-20-17(18(15)22-13(3)19(23)24)14-6-7-16(26-5)21-12(14)2/h6-9,11H,10H2,1-5H3
InChIKeyIJRSOWUYMAGOPO-UHFFFAOYSA-N
MW354.41 g/mol
LogP2.69
Rot. Bonds5

About 5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one

5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one (PubChem CID 22052202) has the molecular formula C19H22N4O3 and a molecular weight of 354.41 g/mol. Its IUPAC name is 5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one.

Molecular Properties

Compound Name5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one
PubChem CID22052202
Molecular FormulaC19H22N4O3
Molecular Weight354.41 g/mol
Exact Mass354.17
IUPAC Name5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one
SMILESCOCC(C)n1c(=O)c(C)nc2c(-c3ccc(OC)nc3C)nccc21
InChIInChI=1S/C19H22N4O3/c1-11(10-25-4)23-15-8-9-20-17(18(15)22-13(3)19(23)24)14-6-7-16(26-5)21-12(14)2/h6-9,11H,10H2,1-5H3
InChIKeyIJRSOWUYMAGOPO-UHFFFAOYSA-N
XLogP2.69
TPSA79.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

8-(6-methoxy-2-methyl-3-pyridinyl)-4-(1-methoxypropan-2-yl)-2-methylpyrido[2,3-b]pyrazin-3-one
CID 21035686
1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one
CID 22052068
5-(2,4-dichlorophenyl)-1-[(2R)-1-methoxybutan-2-yl]-3-methylpyrido[3,4-b]pyrazin-2-one
CID 10385822
4-(2,6-dimethyl-3-pyridinyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 18001474
2-methoxy-3-(1-methoxybutan-2-yl)-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine
CID 18001588
1-[(1R)-1-cyclopropylpropyl]-5-(2,4-dichlorophenyl)-3-methylpyrido[3,4-b]pyrazin-2-one
CID 10385581
1-(1-cyclopropylpropyl)-4-(2,6-dimethoxy-3-pyridinyl)-2-ethylimidazo[4,5-c]pyridine
CID 18001340
4-(5-fluoro-4-methoxy-2-methylphenyl)-2-methoxy-1-(1-methoxybutan-2-yl)imidazo[4,5-c]pyridine
CID 18001490
4-(2,4-dichlorophenyl)-2-methoxy-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 18001464
2-ethyl-4-(5-fluoro-4-methoxy-2-methylphenyl)-1-(1-methoxypentan-3-yl)imidazo[4,5-c]pyridine
CID 18001399
8-[2-chloro-4-(trifluoromethoxy)phenyl]-4-[(2R)-1-methoxybutan-2-yl]-2-methylpyrido[2,3-b]pyrazin-3-one
CID 11744040
4-(5-fluoro-4-methoxy-2-methylphenyl)-2-methoxy-1-pentan-3-ylimidazo[4,5-c]pyridine
CID 18001531

Frequently Asked Questions

What is the IUPAC name of 5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one?
The IUPAC name of 5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one (CID 22052202) is 5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one.
What is the SMILES notation for 5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one?
The canonical SMILES for 5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one is COCC(C)n1c(=O)c(C)nc2c(-c3ccc(OC)nc3C)nccc21.
What is the InChIKey of 5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one?
The InChIKey is IJRSOWUYMAGOPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O3/c1-11(10-25-4)23-15-8-9-20-17(18(15)22-13(3)19(23)24)14-6-7-16(26-5)21-12(14)2/h6-9,11H,10H2,1-5H3.
What are the key properties of 5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one?
5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one has a molecular weight of 354.41 g/mol, XLogP of 2.69, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one is sourced from PubChem (CID 22052202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).