ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate

C13H15N3O4 — CID 82017351

IUPACethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate
SMILESCCOC(=O)Cn1c(=O)c(OCC)nc2cccnc21
InChIInChI=1S/C13H15N3O4/c1-3-19-10(17)8-16-11-9(6-5-7-14-11)15-12(13(16)18)20-4-2/h5-7H,3-4,8H2,1-2H3
InChIKeyUKQFQRMAKNKUQX-UHFFFAOYSA-N
MW277.28 g/mol
LogP0.75
Rot. Bonds5

About ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate

ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate (PubChem CID 82017351) has the molecular formula C13H15N3O4 and a molecular weight of 277.28 g/mol. Its IUPAC name is ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate
PubChem CID82017351
Molecular FormulaC13H15N3O4
Molecular Weight277.28 g/mol
Exact Mass277.11
IUPAC Nameethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate
SMILESCCOC(=O)Cn1c(=O)c(OCC)nc2cccnc21
InChIInChI=1S/C13H15N3O4/c1-3-19-10(17)8-16-11-9(6-5-7-14-11)15-12(13(16)18)20-4-2/h5-7H,3-4,8H2,1-2H3
InChIKeyUKQFQRMAKNKUQX-UHFFFAOYSA-N
XLogP0.75
TPSA83.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.28
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

2-ethoxy-4-(2-oxo-2-pyrrolidin-1-ylethyl)pyrido[2,3-b]pyrazin-3-one
CID 20955227
ethyl 2-(3-ethylimidazo[4,5-b]pyridin-2-yl)pentanoate
CID 79474968
ethyl 2-[[2-[2-(4-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]acetyl]amino]acetate
CID 14390235
2-ethoxy-4-(1-oxo-1-pyrrolidin-1-ylbutan-2-yl)pyrido[2,3-b]pyrazin-3-one
CID 46343992
ethyl 2-methyl-2-(3-propylimidazo[4,5-b]pyridin-2-yl)propanoate
CID 79471291
ethyl 2-(2,4-dioxo-1H-pyrido[3,2-d]pyrimidin-3-yl)acetate
CID 139690765
ethyl 2-(3-cyclopropylimidazo[4,5-b]pyridin-2-yl)acetate
CID 79474872
2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)-N-(2-ethoxyphenyl)butanamide
CID 50794209
ethyl 2-(2,5-dimethylpyrrol-1-yl)acetate
CID 12894114
ethyl 2-[3-[(2-chlorophenyl)methyl]-2,4-dioxopyrido[2,3-d]pyrimidin-1-yl]acetate
CID 6619883
2-(3-oxo-2-phenylpyrido[2,3-b]pyrazin-4-yl)acetic acid
CID 134154466
ethyl 2-(3-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetate
CID 13380693

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate?
The IUPAC name of ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate (CID 82017351) is ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate.
What is the SMILES notation for ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate?
The canonical SMILES for ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate is CCOC(=O)Cn1c(=O)c(OCC)nc2cccnc21.
What is the InChIKey of ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate?
The InChIKey is UKQFQRMAKNKUQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O4/c1-3-19-10(17)8-16-11-9(6-5-7-14-11)15-12(13(16)18)20-4-2/h5-7H,3-4,8H2,1-2H3.
What are the key properties of ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate?
ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate has a molecular weight of 277.28 g/mol, XLogP of 0.75, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-ethoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)acetate is sourced from PubChem (CID 82017351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).