2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone

C16H15FN2O2 — CID 122247174

IUPAC2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone
SMILESO=C(Cc1ccc(F)cc1)N1CC(Oc2ccccn2)C1
InChIInChI=1S/C16H15FN2O2/c17-13-6-4-12(5-7-13)9-16(20)19-10-14(11-19)21-15-3-1-2-8-18-15/h1-8,14H,9-11H2
InChIKeyLEZLTDFQHBNEGJ-UHFFFAOYSA-N
MW286.31 g/mol
LogP2.05
Rot. Bonds4

About 2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone

2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone (PubChem CID 122247174) has the molecular formula C16H15FN2O2 and a molecular weight of 286.31 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone
PubChem CID122247174
Molecular FormulaC16H15FN2O2
Molecular Weight286.31 g/mol
Exact Mass286.11
IUPAC Name2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone
SMILESO=C(Cc1ccc(F)cc1)N1CC(Oc2ccccn2)C1
InChIInChI=1S/C16H15FN2O2/c17-13-6-4-12(5-7-13)9-16(20)19-10-14(11-19)21-15-3-1-2-8-18-15/h1-8,14H,9-11H2
InChIKeyLEZLTDFQHBNEGJ-UHFFFAOYSA-N
XLogP2.05
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-1-(4-pyridin-2-yloxypiperidin-1-yl)ethanone
CID 71798620
1-(3-pyridin-2-yloxyazetidin-1-yl)-2-thiophen-2-ylethanone
CID 122247181
2-(2-methylphenoxy)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone
CID 122247163
2-[1-(4-fluorophenyl)sulfonylazetidin-3-yl]oxypyridine
CID 122247334
3-cyclopentyl-1-(3-pyridin-2-yloxyazetidin-1-yl)propan-1-one
CID 122247079
(3R)-N-(4-fluorophenyl)-3-pyridin-2-yloxypyrrolidine-1-carboxamide
CID 129416268
2-(4-fluorophenyl)-1-(4-pyrazin-2-yloxypiperidin-1-yl)ethanone
CID 90559036
2-(4-fluorophenyl)-1-[3-(6-methoxypyridazin-3-yl)oxypyrrolidin-1-yl]ethanone
CID 90639141
2-(4-fluorophenyl)-1-[(3R,4R)-3-hydroxy-4-phenoxypyrrolidin-1-yl]ethanone
CID 110158922
3,3,3-trifluoro-1-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]propan-1-one
CID 129417057
1-[3-[(3-chloro-2-pyridinyl)oxy]azetidin-1-yl]-2-(4-phenylphenyl)ethanone
CID 122248013
1-(3-aminoazetidin-1-yl)-2-(4-fluorophenyl)ethanone
CID 63753631

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone?
The IUPAC name of 2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone (CID 122247174) is 2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone.
What is the SMILES notation for 2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone?
The canonical SMILES for 2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone is O=C(Cc1ccc(F)cc1)N1CC(Oc2ccccn2)C1.
What is the InChIKey of 2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone?
The InChIKey is LEZLTDFQHBNEGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O2/c17-13-6-4-12(5-7-13)9-16(20)19-10-14(11-19)21-15-3-1-2-8-18-15/h1-8,14H,9-11H2.
What are the key properties of 2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone?
2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone has a molecular weight of 286.31 g/mol, XLogP of 2.05, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-(3-pyridin-2-yloxyazetidin-1-yl)ethanone is sourced from PubChem (CID 122247174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).