ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol

C15H21N3O4 — CID 178051371

IUPACethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol
SMILESCCOC(=O)c1cnc2cc(N3CCOCC3)ccn12.CO
InChIInChI=1S/C14H17N3O3.CH4O/c1-2-20-14(18)12-10-15-13-9-11(3-4-17(12)13)16-5-7-19-8-6-16;1-2/h3-4,9-10H,2,5-8H2,1H3;2H,1H3
InChIKeyINFYVQUHTNIXCS-UHFFFAOYSA-N
MW307.35 g/mol
LogP0.96
Rot. Bonds3

About ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol

ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol (PubChem CID 178051371) has the molecular formula C15H21N3O4 and a molecular weight of 307.35 g/mol. Its IUPAC name is ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol.

Molecular Properties

Compound Nameethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol
PubChem CID178051371
Molecular FormulaC15H21N3O4
Molecular Weight307.35 g/mol
Exact Mass307.15
IUPAC Nameethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol
SMILESCCOC(=O)c1cnc2cc(N3CCOCC3)ccn12.CO
InChIInChI=1S/C14H17N3O3.CH4O/c1-2-20-14(18)12-10-15-13-9-11(3-4-17(12)13)16-5-7-19-8-6-16;1-2/h3-4,9-10H,2,5-8H2,1H3;2H,1H3
InChIKeyINFYVQUHTNIXCS-UHFFFAOYSA-N
XLogP0.96
TPSA76.30 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

ethyl 7-pyrrolidin-1-ylimidazo[1,2-a]pyridine-3-carboxylate
CID 145001485
ethyl 7-fluoroimidazo[1,2-a]pyridine-3-carboxylate
CID 67259301
ethane;ethyl 7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine-3-carboxylate
CID 178093156
ethyl 7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-3-carboxylate
CID 130229964
7-(2,2-difluoroethoxy)imidazo[1,2-a]pyridine-3-carboxylic acid;ethyl 7-(2,2-difluoroethoxy)imidazo[1,2-a]pyridine-3-carboxylate
CID 161088998
ethyl 3-methoxy-5-morpholin-4-ylbenzoate
CID 69175826
ethyl 7-[2-(3,4-dimethylpiperazin-1-yl)ethoxy]imidazo[1,2-a]pyridine-3-carboxylate
CID 123846928
ethyl 1-(4-fluorophenyl)-3-(4-morpholin-4-ylphenyl)pyrazole-5-carboxylate
CID 2405026
ethyl 2-amino-5-morpholin-4-ylpyridine-4-carboxylate
CID 114194649
ethyl 7-[3-(4-fluoro-4-methylpiperidin-1-yl)propoxy]imidazo[1,2-a]pyridine-3-carboxylate
CID 178051681
ethyl 4-methyl-2-morpholin-4-ylpyrimidine-5-carboxylate
CID 12662938
(4-ethoxycarbonylphenyl) 4-morpholin-4-ylpyridin-1-ium-2-carboxylate
CID 9455702

Frequently Asked Questions

What is the IUPAC name of ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol?
The IUPAC name of ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol (CID 178051371) is ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol.
What is the SMILES notation for ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol?
The canonical SMILES for ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol is CCOC(=O)c1cnc2cc(N3CCOCC3)ccn12.CO.
What is the InChIKey of ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol?
The InChIKey is INFYVQUHTNIXCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3.CH4O/c1-2-20-14(18)12-10-15-13-9-11(3-4-17(12)13)16-5-7-19-8-6-16;1-2/h3-4,9-10H,2,5-8H2,1H3;2H,1H3.
What are the key properties of ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol?
ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol has a molecular weight of 307.35 g/mol, XLogP of 0.96, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxylate;methanol is sourced from PubChem (CID 178051371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).