1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone

C15H20FNO2 — CID 53150747

IUPAC1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(CCOc2ccccc2F)CC1
InChIInChI=1S/C15H20FNO2/c1-12(18)17-9-6-13(7-10-17)8-11-19-15-5-3-2-4-14(15)16/h2-5,13H,6-11H2,1H3
InChIKeyQQLXVMLBZBAAHP-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.85
Rot. Bonds4

About 1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone

1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone (PubChem CID 53150747) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is 1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone
PubChem CID53150747
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC Name1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(CCOc2ccccc2F)CC1
InChIInChI=1S/C15H20FNO2/c1-12(18)17-9-6-13(7-10-17)8-11-19-15-5-3-2-4-14(15)16/h2-5,13H,6-11H2,1H3
InChIKeyQQLXVMLBZBAAHP-UHFFFAOYSA-N
XLogP2.85
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

cyclohexyl-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]methanone
CID 53037979
[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]-(5-methylthiophen-2-yl)methanone
CID 50846846
1-[4-(2-phenoxyethyl)piperidin-1-yl]ethanone
CID 53150715
[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]-(oxolan-3-yl)methanone
CID 50846781
(1-ethylpyrazol-3-yl)-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]methanone
CID 50846942
1-[3-(aminomethyl)pyrrolidin-1-yl]-3-(2-fluorophenoxy)propan-1-one
CID 119484287
1-[(2R)-2-[(2S)-1-[2-(2-fluorophenoxy)ethyl]pyrrolidin-2-yl]pyrrolidin-1-yl]ethanone
CID 95307713
1-[4-(3-cyclohexylpropanoyl)piperazin-1-yl]-4-(2-fluorophenoxy)butan-1-one
CID 55956319
1-[2-(3,4-dimethoxyphenyl)ethenyl]-4-[2-(2-fluorophenoxy)ethyl]piperidine
CID 174650212
1-(6-cyclopropylhexoxy)-2-fluorobenzene
CID 91224434
1-[(3S)-3-(aminomethyl)pyrrolidin-1-yl]-2-(2-fluorophenoxy)ethanone
CID 124611644
4-(2-fluorophenoxy)butan-2-one
CID 28948853

Frequently Asked Questions

What is the IUPAC name of 1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone (CID 53150747) is 1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone is CC(=O)N1CCC(CCOc2ccccc2F)CC1.
What is the InChIKey of 1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone?
The InChIKey is QQLXVMLBZBAAHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c1-12(18)17-9-6-13(7-10-17)8-11-19-15-5-3-2-4-14(15)16/h2-5,13H,6-11H2,1H3.
What are the key properties of 1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone?
1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone has a molecular weight of 265.33 g/mol, XLogP of 2.85, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[2-(2-fluorophenoxy)ethyl]piperidin-1-yl]ethanone is sourced from PubChem (CID 53150747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).