ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate

C10H15N3O5 — CID 171866243

IUPACethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate
SMILESCCOC(=O)C(O)C(O)c1cnc(N)c(OC)n1
InChIInChI=1S/C10H15N3O5/c1-3-18-10(16)7(15)6(14)5-4-12-8(11)9(13-5)17-2/h4,6-7,14-15H,3H2,1-2H3,(H2,11,12)
InChIKeyFTDUYVQEXADZHK-UHFFFAOYSA-N
MW257.25 g/mol
LogP-0.98
Rot. Bonds5

About ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate

ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate (PubChem CID 171866243) has the molecular formula C10H15N3O5 and a molecular weight of 257.25 g/mol. Its IUPAC name is ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate.

Molecular Properties

Compound Nameethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate
PubChem CID171866243
Molecular FormulaC10H15N3O5
Molecular Weight257.25 g/mol
Exact Mass257.10
IUPAC Nameethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate
SMILESCCOC(=O)C(O)C(O)c1cnc(N)c(OC)n1
InChIInChI=1S/C10H15N3O5/c1-3-18-10(16)7(15)6(14)5-4-12-8(11)9(13-5)17-2/h4,6-7,14-15H,3H2,1-2H3,(H2,11,12)
InChIKeyFTDUYVQEXADZHK-UHFFFAOYSA-N
XLogP-0.98
TPSA127.79 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.25
LogP ≤ 5-0.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-amino-6-(3-ethoxy-1,2-dihydroxy-3-oxopropyl)pyrazine-2-carboxylic acid
CID 171866602
ethyl 2,3-dihydroxy-3-(5-methoxy-2-pyridinyl)propanoate
CID 171865893
ethyl 2,3-dihydroxy-3-(2-methoxypyrimidin-5-yl)propanoate
CID 171865797
ethyl 4-(5,6-diaminopyrazin-2-yl)-3,4-dihydroxybutanoate
CID 171897017
methyl 2-amino-5-(3-ethoxy-1,2-dihydroxy-3-oxopropyl)pyridine-3-carboxylate
CID 171866731
ethyl 3-(5-chloro-2-pyridinyl)-2,3-dihydroxypropanoate
CID 171865586
ethyl 3-(2-chloropyrimidin-5-yl)-2,3-dihydroxypropanoate
CID 118141576
ethyl 2,3-dihydroxy-3-(1-methylimidazol-4-yl)propanoate
CID 171867145
ethyl 2,3-dihydroxy-3-[5-(trifluoromethyl)-2-pyridinyl]propanoate
CID 171866505
ethyl 3-(3-amino-6-methyl-2-pyridinyl)-2,3-dihydroxypropanoate
CID 171865781
ethyl (3R)-2,3-dihydroxy-3-(4-methyl-1,3-thiazol-5-yl)propanoate
CID 175760966
ethyl 2,3-dihydroxy-3-(4-methoxy-3-pyridinyl)propanoate
CID 171865897

Frequently Asked Questions

What is the IUPAC name of ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate?
The IUPAC name of ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate (CID 171866243) is ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate.
What is the SMILES notation for ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate?
The canonical SMILES for ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate is CCOC(=O)C(O)C(O)c1cnc(N)c(OC)n1.
What is the InChIKey of ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate?
The InChIKey is FTDUYVQEXADZHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O5/c1-3-18-10(16)7(15)6(14)5-4-12-8(11)9(13-5)17-2/h4,6-7,14-15H,3H2,1-2H3,(H2,11,12).
What are the key properties of ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate?
ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate has a molecular weight of 257.25 g/mol, XLogP of -0.98, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-(5-amino-6-methoxypyrazin-2-yl)-2,3-dihydroxypropanoate is sourced from PubChem (CID 171866243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).