2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide

C19H22FN3O3 — CID 91920406

IUPAC2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide
SMILESCOCCN1C(=O)c2cccn2CC1CNC(=O)Cc1ccccc1F
InChIInChI=1S/C19H22FN3O3/c1-26-10-9-23-15(13-22-8-4-7-17(22)19(23)25)12-21-18(24)11-14-5-2-3-6-16(14)20/h2-8,15H,9-13H2,1H3,(H,21,24)
InChIKeyGYTDAEPHLVVGLY-UHFFFAOYSA-N
MW359.40 g/mol
LogP1.46
Rot. Bonds7

About 2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide

2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide (PubChem CID 91920406) has the molecular formula C19H22FN3O3 and a molecular weight of 359.40 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide
PubChem CID91920406
Molecular FormulaC19H22FN3O3
Molecular Weight359.40 g/mol
Exact Mass359.16
IUPAC Name2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide
SMILESCOCCN1C(=O)c2cccn2CC1CNC(=O)Cc1ccccc1F
InChIInChI=1S/C19H22FN3O3/c1-26-10-9-23-15(13-22-8-4-7-17(22)19(23)25)12-21-18(24)11-14-5-2-3-6-16(14)20/h2-8,15H,9-13H2,1H3,(H,21,24)
InChIKeyGYTDAEPHLVVGLY-UHFFFAOYSA-N
XLogP1.46
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.40
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]methanesulfonamide
CID 91920391
N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]-3-phenylpropanamide
CID 91909713
4-fluoro-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]benzamide
CID 91920413
3-cyclopentyl-N-[[(3S)-2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]propanamide
CID 99758090
2-methoxy-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]benzamide
CID 91909710
N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]-6-methylpyridine-3-carboxamide
CID 91920410
4-methoxy-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]benzenesulfonamide
CID 91920395
3-N-cyclooctyl-5-N-[(2-fluorophenyl)methyl]-1-(2-methoxyethyl)-4-oxopyridine-3,5-dicarboxamide
CID 42482348
N-[(2-methyl-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl)methyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 91909626
2-(2-fluorophenyl)-N-(4-hydroxy-1-methoxybutan-2-yl)acetamide
CID 103799437
methyl 4-[[2-(2-fluorophenyl)acetyl]amino]piperidine-1-carboxylate
CID 110821770
N-(4-amino-1-methoxybutan-2-yl)-2-(2-fluorophenyl)acetamide
CID 106152498

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide (CID 91920406) is 2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide is COCCN1C(=O)c2cccn2CC1CNC(=O)Cc1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide?
The InChIKey is GYTDAEPHLVVGLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O3/c1-26-10-9-23-15(13-22-8-4-7-17(22)19(23)25)12-21-18(24)11-14-5-2-3-6-16(14)20/h2-8,15H,9-13H2,1H3,(H,21,24).
What are the key properties of 2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide?
2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide has a molecular weight of 359.40 g/mol, XLogP of 1.46, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-[[2-(2-methoxyethyl)-1-oxo-3,4-dihydropyrrolo[1,2-a]pyrazin-3-yl]methyl]acetamide is sourced from PubChem (CID 91920406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).