ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate

C19H20N4O4 — CID 46945635

IUPACethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate
SMILESCCOC(=O)c1cn2cc(-c3cccc(O)c3)nc(N3CCOCC3)c2n1
InChIInChI=1S/C19H20N4O4/c1-2-27-19(25)16-12-23-11-15(13-4-3-5-14(24)10-13)20-17(18(23)21-16)22-6-8-26-9-7-22/h3-5,10-12,24H,2,6-9H2,1H3
InChIKeyKMLFFYOTNBUIJR-UHFFFAOYSA-N
MW368.39 g/mol
LogP2.12
Rot. Bonds4

About ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate

ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate (PubChem CID 46945635) has the molecular formula C19H20N4O4 and a molecular weight of 368.39 g/mol. Its IUPAC name is ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate.

Molecular Properties

Compound Nameethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate
PubChem CID46945635
Molecular FormulaC19H20N4O4
Molecular Weight368.39 g/mol
Exact Mass368.15
IUPAC Nameethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate
SMILESCCOC(=O)c1cn2cc(-c3cccc(O)c3)nc(N3CCOCC3)c2n1
InChIInChI=1S/C19H20N4O4/c1-2-27-19(25)16-12-23-11-15(13-4-3-5-14(24)10-13)20-17(18(23)21-16)22-6-8-26-9-7-22/h3-5,10-12,24H,2,6-9H2,1H3
InChIKeyKMLFFYOTNBUIJR-UHFFFAOYSA-N
XLogP2.12
TPSA89.19 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate?
The IUPAC name of ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate (CID 46945635) is ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate.
What is the SMILES notation for ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate?
The canonical SMILES for ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate is CCOC(=O)c1cn2cc(-c3cccc(O)c3)nc(N3CCOCC3)c2n1.
What is the InChIKey of ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate?
The InChIKey is KMLFFYOTNBUIJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O4/c1-2-27-19(25)16-12-23-11-15(13-4-3-5-14(24)10-13)20-17(18(23)21-16)22-6-8-26-9-7-22/h3-5,10-12,24H,2,6-9H2,1H3.
What are the key properties of ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate?
ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate has a molecular weight of 368.39 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate is sourced from PubChem (CID 46945635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).