2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone

C19H21FN2O3 — CID 71799565

IUPAC2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone
SMILESCc1cccc(OC2CCN(C(=O)COc3ccccc3F)CC2)n1
InChIInChI=1S/C19H21FN2O3/c1-14-5-4-8-18(21-14)25-15-9-11-22(12-10-15)19(23)13-24-17-7-3-2-6-16(17)20/h2-8,15H,9-13H2,1H3
InChIKeyUOVIFXOSWQZOOS-UHFFFAOYSA-N
MW344.39 g/mol
LogP2.98
Rot. Bonds5

About 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone

2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone (PubChem CID 71799565) has the molecular formula C19H21FN2O3 and a molecular weight of 344.39 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone
PubChem CID71799565
Molecular FormulaC19H21FN2O3
Molecular Weight344.39 g/mol
Exact Mass344.15
IUPAC Name2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone
SMILESCc1cccc(OC2CCN(C(=O)COc3ccccc3F)CC2)n1
InChIInChI=1S/C19H21FN2O3/c1-14-5-4-8-18(21-14)25-15-9-11-22(12-10-15)19(23)13-24-17-7-3-2-6-16(17)20/h2-8,15H,9-13H2,1H3
InChIKeyUOVIFXOSWQZOOS-UHFFFAOYSA-N
XLogP2.98
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
The IUPAC name of 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone (CID 71799565) is 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone.
What is the SMILES notation for 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
The canonical SMILES for 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone is Cc1cccc(OC2CCN(C(=O)COc3ccccc3F)CC2)n1.
What is the InChIKey of 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
The InChIKey is UOVIFXOSWQZOOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O3/c1-14-5-4-8-18(21-14)25-15-9-11-22(12-10-15)19(23)13-24-17-7-3-2-6-16(17)20/h2-8,15H,9-13H2,1H3.
What are the key properties of 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone?
2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone has a molecular weight of 344.39 g/mol, XLogP of 2.98, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-1-[4-[(6-methyl-2-pyridinyl)oxy]piperidin-1-yl]ethanone is sourced from PubChem (CID 71799565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).