1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone

C24H24F2N4O2 — CID 158469732

IUPAC1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone
SMILESCCn1nc(C)c(CC(=O)c2c(C)nc3c(OCc4c(F)cccc4F)cccn23)c1C
InChIInChI=1S/C24H24F2N4O2/c1-5-30-16(4)17(14(2)28-30)12-21(31)23-15(3)27-24-22(10-7-11-29(23)24)32-13-18-19(25)8-6-9-20(18)26/h6-11H,5,12-13H2,1-4H3
InChIKeyHGEYTOAJXOZLRR-UHFFFAOYSA-N
MW438.48 g/mol
LogP4.76
Rot. Bonds7

About 1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone

1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone (PubChem CID 158469732) has the molecular formula C24H24F2N4O2 and a molecular weight of 438.48 g/mol. Its IUPAC name is 1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone.

Molecular Properties

Compound Name1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone
PubChem CID158469732
Molecular FormulaC24H24F2N4O2
Molecular Weight438.48 g/mol
Exact Mass438.19
IUPAC Name1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone
SMILESCCn1nc(C)c(CC(=O)c2c(C)nc3c(OCc4c(F)cccc4F)cccn23)c1C
InChIInChI=1S/C24H24F2N4O2/c1-5-30-16(4)17(14(2)28-30)12-21(31)23-15(3)27-24-22(10-7-11-29(23)24)32-13-18-19(25)8-6-9-20(18)26/h6-11H,5,12-13H2,1-4H3
InChIKeyHGEYTOAJXOZLRR-UHFFFAOYSA-N
XLogP4.76
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.48
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-[1-(2-hydroxyethyl)-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]ethanone
CID 161238104
8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carbonyl chloride
CID 86717886
(3S)-1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-3-(hydroxymethyl)hexan-1-one
CID 147859544
(4S)-1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-4-hydroxy-4-phenylbutan-1-one;methane
CID 160857855
tert-butyl 3-[2-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-oxoethyl]indazole-1-carboxylate
CID 158696585
tert-butyl N-[[2-[2-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-oxoethyl]-5-fluorophenyl]methyl]carbamate
CID 149039486
N-[2-[4-[2-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-oxoethyl]pyrazol-1-yl]ethyl]ethanesulfonamide
CID 159501972
8-[(2,6-difluorophenyl)methoxy]-N-(3-hydroxybutyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 90135188
8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 118144957
1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-[(1R,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]ethanone
CID 159220216
1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-4-hydroxy-3-[4-(hydroxymethyl)phenyl]-3-methylbutan-1-one
CID 157199247
1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]ethanone
CID 159220214

Frequently Asked Questions

What is the IUPAC name of 1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone?
The IUPAC name of 1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone (CID 158469732) is 1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone.
What is the SMILES notation for 1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone?
The canonical SMILES for 1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone is CCn1nc(C)c(CC(=O)c2c(C)nc3c(OCc4c(F)cccc4F)cccn23)c1C.
What is the InChIKey of 1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone?
The InChIKey is HGEYTOAJXOZLRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24F2N4O2/c1-5-30-16(4)17(14(2)28-30)12-21(31)23-15(3)27-24-22(10-7-11-29(23)24)32-13-18-19(25)8-6-9-20(18)26/h6-11H,5,12-13H2,1-4H3.
What are the key properties of 1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone?
1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone has a molecular weight of 438.48 g/mol, XLogP of 4.76, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanone is sourced from PubChem (CID 158469732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).