2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone

C23H27N3O3 — CID 147893444

IUPAC2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone
SMILESCCOCC(=O)N1CCC(Oc2ccc(-c3ccc4nccn4c3C)cc2)CC1
InChIInChI=1S/C23H27N3O3/c1-3-28-16-23(27)25-13-10-20(11-14-25)29-19-6-4-18(5-7-19)21-8-9-22-24-12-15-26(22)17(21)2/h4-9,12,15,20H,3,10-11,13-14,16H2,1-2H3
InChIKeyICVJSTWUTUMQJJ-UHFFFAOYSA-N
MW393.49 g/mol
LogP3.72
Rot. Bonds6

About 2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone

2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone (PubChem CID 147893444) has the molecular formula C23H27N3O3 and a molecular weight of 393.49 g/mol. Its IUPAC name is 2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone
PubChem CID147893444
Molecular FormulaC23H27N3O3
Molecular Weight393.49 g/mol
Exact Mass393.21
IUPAC Name2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone
SMILESCCOCC(=O)N1CCC(Oc2ccc(-c3ccc4nccn4c3C)cc2)CC1
InChIInChI=1S/C23H27N3O3/c1-3-28-16-23(27)25-13-10-20(11-14-25)29-19-6-4-18(5-7-19)21-8-9-22-24-12-15-26(22)17(21)2/h4-9,12,15,20H,3,10-11,13-14,16H2,1-2H3
InChIKeyICVJSTWUTUMQJJ-UHFFFAOYSA-N
XLogP3.72
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.49
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone with MolForge

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Related Compounds

1-[4-[4-(5-chloroimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]-2-propan-2-yloxyethanone
CID 148636076
2-ethoxy-1-[4-[4-(4-methylquinolin-3-yl)phenoxy]piperidin-1-yl]ethanone
CID 147036315
2-ethoxy-1-(4-phenoxypiperidin-1-yl)ethanone
CID 61381248
4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidine-1-carboxamide;[(2S)-1-methylpyrrolidin-2-yl]-[4-[4-(8-methylquinolin-7-yl)phenoxy]piperidin-1-yl]methanone;[(2R)-1-methylpyrrolidin-2-yl]-[4-[4-(8-methylquinolin-7-yl)phenoxy]piperidin-1-yl]methanone
CID 175127712
2-ethoxy-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
CID 71798598
2-(4-ethoxyphenoxy)-1-[4-(4-pyridin-4-yloxypiperidin-1-yl)piperidin-1-yl]ethanone
CID 90617176
7-[4-(1-propanoylpiperidin-4-yl)oxyphenyl]quinoline-8-carboxylic acid
CID 142800445
2-methoxy-1-[4-(4-methoxyphenoxy)piperidin-1-yl]ethanone
CID 70724680
2-(4-ethoxyphenoxy)-1-[4-(2-methylpyrimidin-4-yl)oxypiperidin-1-yl]ethanone
CID 121162479
2-ethoxy-1-[4-(6-pyrazol-1-ylpyridazin-3-yl)oxypiperidin-1-yl]ethanone
CID 121162979
2-ethoxy-1-(4-hydroxypiperidin-1-yl)ethanone
CID 43391718
ethyl 4-(4-formylphenoxy)piperidine-1-carboxylate
CID 18980164

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone?
The IUPAC name of 2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone (CID 147893444) is 2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone.
What is the SMILES notation for 2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone?
The canonical SMILES for 2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone is CCOCC(=O)N1CCC(Oc2ccc(-c3ccc4nccn4c3C)cc2)CC1.
What is the InChIKey of 2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone?
The InChIKey is ICVJSTWUTUMQJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O3/c1-3-28-16-23(27)25-13-10-20(11-14-25)29-19-6-4-18(5-7-19)21-8-9-22-24-12-15-26(22)17(21)2/h4-9,12,15,20H,3,10-11,13-14,16H2,1-2H3.
What are the key properties of 2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone?
2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone has a molecular weight of 393.49 g/mol, XLogP of 3.72, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-[4-[4-(5-methylimidazo[1,2-a]pyridin-6-yl)phenoxy]piperidin-1-yl]ethanone is sourced from PubChem (CID 147893444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).