5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one

C12H15N3O2 — CID 137448946

IUPAC5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one
SMILESCOc1cnc2ccc(=O)n(C(C)(C)C)c2n1
InChIInChI=1S/C12H15N3O2/c1-12(2,3)15-10(16)6-5-8-11(15)14-9(17-4)7-13-8/h5-7H,1-4H3
InChIKeyOJXCRORAMPLNKZ-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.56
Rot. Bonds1

About 5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one

5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one (PubChem CID 137448946) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is 5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one.

Molecular Properties

Compound Name5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one
PubChem CID137448946
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one
SMILESCOc1cnc2ccc(=O)n(C(C)(C)C)c2n1
InChIInChI=1S/C12H15N3O2/c1-12(2,3)15-10(16)6-5-8-11(15)14-9(17-4)7-13-8/h5-7H,1-4H3
InChIKeyOJXCRORAMPLNKZ-UHFFFAOYSA-N
XLogP1.56
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2,2-dimethoxyethyl)-6-methoxypyrido[2,3-b]pyrazin-3-one
CID 53302190
tert-butyl-[1-[(2S)-2-hydroxy-4-(3-methoxy-6-oxopyrido[2,3-b]pyrazin-5-yl)butyl]piperidin-4-yl]carbamic acid
CID 66839927
2-methoxy-6H-pyrido[3,4-b]pyrazin-5-one
CID 122435153
ethane;2-methoxy-7,8-dimethylquinoxaline
CID 145260864
2-methoxypyrido[3,4-b]pyrazine
CID 118866436
tert-butyl N-[(2R)-2-(6-fluoro-3-methoxyquinoxalin-5-yl)-2-hydroxyethyl]carbamate
CID 67131153
1-(2-methoxyquinoxalin-6-yl)cyclopropan-1-ol
CID 117307968
4-[(4-methoxyphenyl)methyl]-6-prop-1-en-2-ylpyrido[2,3-b]pyrazin-3-one
CID 143410992
2-[5-methoxy-3-(2-methylbutan-2-yl)imidazo[4,5-b]pyridin-2-yl]sulfanylacetic acid
CID 115322061
tert-butyl N-[[3-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)-7,8-dihydro-5H-pyrano[4,3-b]pyridin-8-yl]methyl]carbamate
CID 86643901
1-(3-methoxyquinoxalin-5-yl)ethanone
CID 69059275
2,6-dimethoxypyridazin-3-one
CID 21124362

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one?
The IUPAC name of 5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one (CID 137448946) is 5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one.
What is the SMILES notation for 5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one?
The canonical SMILES for 5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one is COc1cnc2ccc(=O)n(C(C)(C)C)c2n1.
What is the InChIKey of 5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one?
The InChIKey is OJXCRORAMPLNKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-12(2,3)15-10(16)6-5-8-11(15)14-9(17-4)7-13-8/h5-7H,1-4H3.
What are the key properties of 5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one?
5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one has a molecular weight of 233.27 g/mol, XLogP of 1.56, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-3-methoxypyrido[2,3-b]pyrazin-6-one is sourced from PubChem (CID 137448946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).