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

C22H26N4O2 — CID 22052068

IUPAC1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one
SMILESCCC(C1CCC1)n1c(=O)c(C)nc2c(-c3ccc(OC)nc3C)nccc21
InChIInChI=1S/C22H26N4O2/c1-5-17(15-7-6-8-15)26-18-11-12-23-20(21(18)25-14(3)22(26)27)16-9-10-19(28-4)24-13(16)2/h9-12,15,17H,5-8H2,1-4H3
InChIKeyKYXQTUSZXOGZQZ-UHFFFAOYSA-N
MW378.48 g/mol
LogP4.23
Rot. Bonds5

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

1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one (PubChem CID 22052068) has the molecular formula C22H26N4O2 and a molecular weight of 378.48 g/mol. Its IUPAC name is 1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one.

Molecular Properties

Compound Name1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one
PubChem CID22052068
Molecular FormulaC22H26N4O2
Molecular Weight378.48 g/mol
Exact Mass378.21
IUPAC Name1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one
SMILESCCC(C1CCC1)n1c(=O)c(C)nc2c(-c3ccc(OC)nc3C)nccc21
InChIInChI=1S/C22H26N4O2/c1-5-17(15-7-6-8-15)26-18-11-12-23-20(21(18)25-14(3)22(26)27)16-9-10-19(28-4)24-13(16)2/h9-12,15,17H,5-8H2,1-4H3
InChIKeyKYXQTUSZXOGZQZ-UHFFFAOYSA-N
XLogP4.23
TPSA69.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.48
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one with MolForge

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Related Compounds

5-(6-methoxy-2-methyl-3-pyridinyl)-1-(1-methoxypropan-2-yl)-3-methylpyrido[3,4-b]pyrazin-2-one
CID 22052202
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
8-(2-chloro-4-methoxyphenyl)-4-(1-cyclopropylpropyl)-2-methylpyrido[2,3-b]pyrazin-3-one
CID 22052152
8-(2-chloro-4-methoxy-5-methylphenyl)-4-(1-cyclopropylpropyl)-2-methylpyrido[2,3-b]pyrazin-3-one
CID 10408534
8-(6-methoxy-2-methyl-3-pyridinyl)-4-(1-methoxypropan-2-yl)-2-methylpyrido[2,3-b]pyrazin-3-one
CID 21035686
2-methoxy-3-(1-methoxybutan-2-yl)-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine
CID 18001588
3-[1-(1-cyclopropylpropyl)-2-ethylimidazol-4-yl]-2,6-dimethoxypyridine
CID 70282589
8-[2-chloro-4-(trifluoromethoxy)phenyl]-4-[(1S)-1-cyclopropylbutyl]-2-methylpyrido[2,3-b]pyrazin-3-one
CID 10343816
propan-2-yl 4-[3-(6-methoxy-2-methyl-3-pyridinyl)-1-methylpyrazolo[4,5-d]pyrimidin-7-yl]oxypiperidine-1-carboxylate
CID 58735208
8-(2-chloro-4-methoxyphenyl)-4-heptan-4-yl-2-methylpyrido[2,3-b]pyrazin-3-one
CID 10386244
2-ethyl-4-[4-methoxy-2-(trifluoromethyl)phenyl]-1-pentan-3-ylimidazo[4,5-c]pyridine
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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one?
The IUPAC name of 1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one (CID 22052068) is 1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one.
What is the SMILES notation for 1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one?
The canonical SMILES for 1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one is CCC(C1CCC1)n1c(=O)c(C)nc2c(-c3ccc(OC)nc3C)nccc21.
What is the InChIKey of 1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one?
The InChIKey is KYXQTUSZXOGZQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O2/c1-5-17(15-7-6-8-15)26-18-11-12-23-20(21(18)25-14(3)22(26)27)16-9-10-19(28-4)24-13(16)2/h9-12,15,17H,5-8H2,1-4H3.
What are the key properties of 1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one?
1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one has a molecular weight of 378.48 g/mol, XLogP of 4.23, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclobutylpropyl)-5-(6-methoxy-2-methyl-3-pyridinyl)-3-methylpyrido[3,4-b]pyrazin-2-one is sourced from PubChem (CID 22052068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).