1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone

C15H20FNO2 — CID 43228410

IUPAC1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone
SMILESCOc1ccc(F)cc1C(=O)CN1CCCCC1C
InChIInChI=1S/C15H20FNO2/c1-11-5-3-4-8-17(11)10-14(18)13-9-12(16)6-7-15(13)19-2/h6-7,9,11H,3-5,8,10H2,1-2H3
InChIKeyZCOBUOWWIRXHNZ-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.89
Rot. Bonds4

About 1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone

1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone (PubChem CID 43228410) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is 1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone
PubChem CID43228410
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC Name1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone
SMILESCOc1ccc(F)cc1C(=O)CN1CCCCC1C
InChIInChI=1S/C15H20FNO2/c1-11-5-3-4-8-17(11)10-14(18)13-9-12(16)6-7-15(13)19-2/h6-7,9,11H,3-5,8,10H2,1-2H3
InChIKeyZCOBUOWWIRXHNZ-UHFFFAOYSA-N
XLogP2.89
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-ethylpiperidin-1-yl)-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 43227563
1-(5-fluoro-2-methoxyphenyl)-2-(2-propylpiperidin-1-yl)ethanone
CID 83043920
1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone
CID 43228143
1-(3-chloro-4-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone
CID 43228414
2-(4-ethyl-3-methylpiperazin-1-yl)-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 63609080
1-(5-fluoro-2-methoxyphenyl)-2-thiomorpholin-4-ylethanone
CID 62051168
1-(2-fluorophenyl)-2-[(2R)-2-methylpiperidin-1-yl]ethanone
CID 2422526
1-(2-fluorophenyl)-2-(2-methylpiperidin-1-yl)ethanone
CID 5149362
2-[cyclopentyl(methyl)amino]-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 43795234
2-(2,6-dimethylmorpholin-4-yl)-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 43227111
2-cyclobutyl-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 103162387
1-(5-fluoro-2-methoxyphenyl)-2-[3-(hydroxymethyl)pyrrolidin-1-yl]ethanone
CID 112626411

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone?
The IUPAC name of 1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone (CID 43228410) is 1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone.
What is the SMILES notation for 1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone?
The canonical SMILES for 1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone is COc1ccc(F)cc1C(=O)CN1CCCCC1C.
What is the InChIKey of 1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone?
The InChIKey is ZCOBUOWWIRXHNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c1-11-5-3-4-8-17(11)10-14(18)13-9-12(16)6-7-15(13)19-2/h6-7,9,11H,3-5,8,10H2,1-2H3.
What are the key properties of 1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone?
1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone has a molecular weight of 265.33 g/mol, XLogP of 2.89, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone is sourced from PubChem (CID 43228410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).