1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone

C17H24N4O2 — CID 110090586

IUPAC1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone
SMILESCOCCN1CCN(C(=O)Cc2c(C)nc3ccccn23)CC1
InChIInChI=1S/C17H24N4O2/c1-14-15(21-6-4-3-5-16(21)18-14)13-17(22)20-9-7-19(8-10-20)11-12-23-2/h3-6H,7-13H2,1-2H3
InChIKeyZBMOXBGQLHBODC-UHFFFAOYSA-N
MW316.40 g/mol
LogP0.98
Rot. Bonds5

About 1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone

1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone (PubChem CID 110090586) has the molecular formula C17H24N4O2 and a molecular weight of 316.40 g/mol. Its IUPAC name is 1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone.

Molecular Properties

Compound Name1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone
PubChem CID110090586
Molecular FormulaC17H24N4O2
Molecular Weight316.40 g/mol
Exact Mass316.19
IUPAC Name1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone
SMILESCOCCN1CCN(C(=O)Cc2c(C)nc3ccccn23)CC1
InChIInChI=1S/C17H24N4O2/c1-14-15(21-6-4-3-5-16(21)18-14)13-17(22)20-9-7-19(8-10-20)11-12-23-2/h3-6H,7-13H2,1-2H3
InChIKeyZBMOXBGQLHBODC-UHFFFAOYSA-N
XLogP0.98
TPSA50.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-benzylpiperazin-1-yl)-3-(2-methylimidazo[1,2-a]pyridin-3-yl)propan-1-one
CID 84565909
3-(2-methoxyethyl)-2-methylimidazo[1,2-a]pyridine
CID 130909325
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone
CID 127247124
N-(3-methoxypropyl)-3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 84565197
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[(3S)-3-(1H-pyrazol-5-ylmethyl)piperidin-1-yl]ethanone
CID 124998993
1-[4-(2-fluorophenyl)piperazin-1-yl]-3-(2-methylimidazo[1,2-a]pyridin-3-yl)propan-1-one
CID 84561418
3-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-(4-pyrrolidin-1-ylbutyl)propanamide
CID 84565906
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]ethanone
CID 124967892
2-[2-(methoxymethyl)-1-[2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetyl]pyrrolidin-2-yl]acetamide
CID 132764656
1-[(5S,6S)-6-hydroxy-1-oxa-9-azaspiro[4.5]decan-9-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone
CID 110156945
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-1-[(3S)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]ethanone
CID 124998104
3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine-2-carboxylic acid
CID 39121604

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone?
The IUPAC name of 1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone (CID 110090586) is 1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone.
What is the SMILES notation for 1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone?
The canonical SMILES for 1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone is COCCN1CCN(C(=O)Cc2c(C)nc3ccccn23)CC1.
What is the InChIKey of 1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone?
The InChIKey is ZBMOXBGQLHBODC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-14-15(21-6-4-3-5-16(21)18-14)13-17(22)20-9-7-19(8-10-20)11-12-23-2/h3-6H,7-13H2,1-2H3.
What are the key properties of 1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone?
1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone has a molecular weight of 316.40 g/mol, XLogP of 0.98, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methoxyethyl)piperazin-1-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone is sourced from PubChem (CID 110090586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).