ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate

C14H17BrN4O3 — CID 162374440

IUPACethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate
SMILESCCOC(=O)c1nc2c(N3CCOCC3)nc(Br)cn2c1C
InChIInChI=1S/C14H17BrN4O3/c1-3-22-14(20)11-9(2)19-8-10(15)16-12(13(19)17-11)18-4-6-21-7-5-18/h8H,3-7H2,1-2H3
InChIKeyVJVYSSGLPASVNI-UHFFFAOYSA-N
MW369.22 g/mol
LogP1.81
Rot. Bonds3

About ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate

ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate (PubChem CID 162374440) has the molecular formula C14H17BrN4O3 and a molecular weight of 369.22 g/mol. Its IUPAC name is ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate.

Molecular Properties

Compound Nameethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate
PubChem CID162374440
Molecular FormulaC14H17BrN4O3
Molecular Weight369.22 g/mol
Exact Mass368.05
IUPAC Nameethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate
SMILESCCOC(=O)c1nc2c(N3CCOCC3)nc(Br)cn2c1C
InChIInChI=1S/C14H17BrN4O3/c1-3-22-14(20)11-9(2)19-8-10(15)16-12(13(19)17-11)18-4-6-21-7-5-18/h8H,3-7H2,1-2H3
InChIKeyVJVYSSGLPASVNI-UHFFFAOYSA-N
XLogP1.81
TPSA68.96 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.22
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate 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

ethyl 5-ethoxy-6-morpholin-4-ylpyrimidine-4-carboxylate
CID 123952017
ethyl 4-morpholin-4-ylphthalazine-1-carboxylate
CID 42878220
ethyl 5-morpholin-4-ylimidazo[1,5-a]quinazoline-3-carboxylate
CID 18953495
ethyl 3,6-dibromo-8-cyclopropylimidazo[1,2-a]pyrazine-2-carboxylate
CID 154727950
ethyl 2-acetyl-5-morpholin-4-yl-1,3-thiazole-4-carboxylate
CID 134461219
ethyl 5-morpholin-4-yltriazolo[1,5-a]quinazoline-3-carboxylate
CID 2816171
ethyl 6-bromo-8-(4-morpholin-4-ylanilino)imidazo[1,2-a]pyrazine-2-carboxylate
CID 162352132
2-[6-bromo-2-(hydroxymethyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]ethanol
CID 52917384
ethyl 8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate
CID 14207617
N-[(6-bromo-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl)methyl]acetamide
CID 175883938
ethyl 2-(3,5-difluorophenyl)-5-ethoxy-6-morpholin-4-ylpyrimidine-4-carboxylate
CID 67295376
methyl 3-bromo-6-(2-methoxy-2-oxoethyl)-1-morpholin-4-ylpyrrolo[1,2-a]pyrazine-7-carboxylate
CID 89398374

Frequently Asked Questions

What is the IUPAC name of ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate?
The IUPAC name of ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate (CID 162374440) is ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate.
What is the SMILES notation for ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate?
The canonical SMILES for ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate is CCOC(=O)c1nc2c(N3CCOCC3)nc(Br)cn2c1C.
What is the InChIKey of ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate?
The InChIKey is VJVYSSGLPASVNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17BrN4O3/c1-3-22-14(20)11-9(2)19-8-10(15)16-12(13(19)17-11)18-4-6-21-7-5-18/h8H,3-7H2,1-2H3.
What are the key properties of ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate?
ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate has a molecular weight of 369.22 g/mol, XLogP of 1.81, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6-bromo-3-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxylate is sourced from PubChem (CID 162374440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).