2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone

C17H18FN3O2 — CID 90559036

IUPAC2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone
SMILESO=C(Cc1ccc(F)cc1)N1CCC(Oc2cnccn2)CC1
InChIInChI=1S/C17H18FN3O2/c18-14-3-1-13(2-4-14)11-17(22)21-9-5-15(6-10-21)23-16-12-19-7-8-20-16/h1-4,7-8,12,15H,5-6,9-11H2
InChIKeyFNFBTDDJNUULEH-UHFFFAOYSA-N
MW315.35 g/mol
LogP2.23
Rot. Bonds4

About 2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone

2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone (PubChem CID 90559036) has the molecular formula C17H18FN3O2 and a molecular weight of 315.35 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone
PubChem CID90559036
Molecular FormulaC17H18FN3O2
Molecular Weight315.35 g/mol
Exact Mass315.14
IUPAC Name2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone
SMILESO=C(Cc1ccc(F)cc1)N1CCC(Oc2cnccn2)CC1
InChIInChI=1S/C17H18FN3O2/c18-14-3-1-13(2-4-14)11-17(22)21-9-5-15(6-10-21)23-16-12-19-7-8-20-16/h1-4,7-8,12,15H,5-6,9-11H2
InChIKeyFNFBTDDJNUULEH-UHFFFAOYSA-N
XLogP2.23
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.35
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-propan-2-ylphenyl)-1-(3-pyrazin-2-yloxypyrrolidin-1-yl)ethanone
CID 90636279
1-[(3S)-3-pyrazin-2-yloxypyrrolidin-1-yl]-2-pyridin-3-ylethanone
CID 100753789
2-(4-fluorophenyl)sulfanyl-1-(3-pyrazin-2-yloxypyrrolidin-1-yl)ethanone
CID 90636191
3-chloro-1-(4-pyrazin-2-yloxypiperidin-1-yl)propan-1-one
CID 90558978
4-chloro-1-(4-pyrazin-2-yloxypiperidin-1-yl)butan-1-one
CID 90558979
1-[4-(2,6-dimethylpyrimidin-4-yl)oxypiperidin-1-yl]-2-(4-fluorophenyl)ethanone
CID 121160857
2-(4-fluorophenyl)-1-[4-(4-pyridin-4-yloxypiperidin-1-yl)piperidin-1-yl]ethanone
CID 90617113
2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
CID 71798620
(2-chloro-4-fluorophenyl)-(4-pyrazin-2-yloxypiperidin-1-yl)methanone
CID 90559064
1-[4-(4-fluorophenoxy)piperidin-1-yl]-2-phenylethanone
CID 110396939
1-[4-(5-fluoropyrimidin-2-yl)oxypiperidin-1-yl]-2-phenylethanone
CID 139023328
2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone
CID 122247174

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone?
The IUPAC name of 2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone (CID 90559036) is 2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone.
What is the SMILES notation for 2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone?
The canonical SMILES for 2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone is O=C(Cc1ccc(F)cc1)N1CCC(Oc2cnccn2)CC1.
What is the InChIKey of 2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone?
The InChIKey is FNFBTDDJNUULEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN3O2/c18-14-3-1-13(2-4-14)11-17(22)21-9-5-15(6-10-21)23-16-12-19-7-8-20-16/h1-4,7-8,12,15H,5-6,9-11H2.
What are the key properties of 2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone?
2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone has a molecular weight of 315.35 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone is sourced from PubChem (CID 90559036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).