2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone

C17H21N3O3 — CID 110117688

IUPAC2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone
SMILESCCOCC(=O)N1Cc2nccn2CC1c1ccccc1OC
InChIInChI=1S/C17H21N3O3/c1-3-23-12-17(21)20-11-16-18-8-9-19(16)10-14(20)13-6-4-5-7-15(13)22-2/h4-9,14H,3,10-12H2,1-2H3
InChIKeyPRMUINOYVAKLEV-UHFFFAOYSA-N
MW315.37 g/mol
LogP2.01
Rot. Bonds5

About 2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone

2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone (PubChem CID 110117688) has the molecular formula C17H21N3O3 and a molecular weight of 315.37 g/mol. Its IUPAC name is 2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone.

Molecular Properties

Compound Name2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone
PubChem CID110117688
Molecular FormulaC17H21N3O3
Molecular Weight315.37 g/mol
Exact Mass315.16
IUPAC Name2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone
SMILESCCOCC(=O)N1Cc2nccn2CC1c1ccccc1OC
InChIInChI=1S/C17H21N3O3/c1-3-23-12-17(21)20-11-16-18-8-9-19(16)10-14(20)13-6-4-5-7-15(13)22-2/h4-9,14H,3,10-12H2,1-2H3
InChIKeyPRMUINOYVAKLEV-UHFFFAOYSA-N
XLogP2.01
TPSA56.59 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-2-(methylamino)ethanone
CID 110117698
(1,3-dimethylpyrazol-4-yl)-[(6R)-6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
CID 125024898
(1,3-dimethylpyrazol-4-yl)-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
CID 110117628
[(6R)-6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-piperidin-4-ylmethanone
CID 124946881
(3,5-dimethyl-1,2-oxazol-4-yl)-[(6R)-6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]methanone
CID 124973670
(6R)-6-(2-methoxyphenyl)-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 124973235
3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one
CID 125015168
3-(4-fluorophenyl)-1-[(6R)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one
CID 124989150
2-ethoxy-1-[(6R)-6-(pyrrolidin-1-ylmethyl)-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepin-8-yl]ethanone
CID 97462833
2-ethoxy-1-[(6R)-6-(prop-2-enoxymethyl)-5,6,7,9-tetrahydroimidazo[1,2-a][1,4]diazepin-8-yl]ethanone
CID 97462312
3-(2-fluorophenyl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one
CID 124999583
1-[3-(2-methoxyphenyl)-4-methylpiperazin-1-yl]-2-pyrazol-1-ylethanone
CID 110098353

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone?
The IUPAC name of 2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone (CID 110117688) is 2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone.
What is the SMILES notation for 2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone?
The canonical SMILES for 2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone is CCOCC(=O)N1Cc2nccn2CC1c1ccccc1OC.
What is the InChIKey of 2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone?
The InChIKey is PRMUINOYVAKLEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3/c1-3-23-12-17(21)20-11-16-18-8-9-19(16)10-14(20)13-6-4-5-7-15(13)22-2/h4-9,14H,3,10-12H2,1-2H3.
What are the key properties of 2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone?
2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone has a molecular weight of 315.37 g/mol, XLogP of 2.01, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-[6-(2-methoxyphenyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone is sourced from PubChem (CID 110117688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).