1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone

C15H20FNO2 — CID 43228143

IUPAC1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone
SMILESCOc1ccc(F)cc1C(=O)CN1CCC(C)CC1
InChIInChI=1S/C15H20FNO2/c1-11-5-7-17(8-6-11)10-14(18)13-9-12(16)3-4-15(13)19-2/h3-4,9,11H,5-8,10H2,1-2H3
InChIKeyPYQWYFOCCPWMTP-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.75
Rot. Bonds4

About 1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone

1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone (PubChem CID 43228143) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is 1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone
PubChem CID43228143
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC Name1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone
SMILESCOc1ccc(F)cc1C(=O)CN1CCC(C)CC1
InChIInChI=1S/C15H20FNO2/c1-11-5-7-17(8-6-11)10-14(18)13-9-12(16)3-4-15(13)19-2/h3-4,9,11H,5-8,10H2,1-2H3
InChIKeyPYQWYFOCCPWMTP-UHFFFAOYSA-N
XLogP2.75
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 ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethoxypiperidin-1-yl)-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 61216852
1-(2,5-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanone
CID 43219785
1-(5-fluoro-2-methoxyphenyl)-2-thiomorpholin-4-ylethanone
CID 62051168
1-(5-fluoro-2-methoxyphenyl)-2-[3-(hydroxymethyl)pyrrolidin-1-yl]ethanone
CID 112626411
2-(2,6-dimethylmorpholin-4-yl)-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 43227111
2-(4-ethyl-3-methylpiperazin-1-yl)-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 63609080
2-methoxy-5-[2-(4-methylpiperidin-1-yl)acetyl]benzoic acid
CID 82052341
1-(5-fluoro-2-methoxyphenyl)-2-(2-methylpiperidin-1-yl)ethanone
CID 43228410
1-[2-(5-fluoro-2-methoxyphenyl)-2-oxoethyl]-4-methylpyrrolidin-2-one
CID 63102449
2-(2-ethylpiperidin-1-yl)-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 43227563
4-[2-(5-fluoro-2-methoxyphenyl)-2-oxoethyl]-1,4-diazepan-2-one
CID 65366237
2-(aziridin-1-yl)-1-(2,5-dimethoxyphenyl)ethanone
CID 94683814

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone?
The IUPAC name of 1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone (CID 43228143) is 1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone.
What is the SMILES notation for 1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone?
The canonical SMILES for 1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone is COc1ccc(F)cc1C(=O)CN1CCC(C)CC1.
What is the InChIKey of 1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone?
The InChIKey is PYQWYFOCCPWMTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c1-11-5-7-17(8-6-11)10-14(18)13-9-12(16)3-4-15(13)19-2/h3-4,9,11H,5-8,10H2,1-2H3.
What are the key properties of 1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone?
1-(5-fluoro-2-methoxyphenyl)-2-(4-methylpiperidin-1-yl)ethanone has a molecular weight of 265.33 g/mol, XLogP of 2.75, 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-(4-methylpiperidin-1-yl)ethanone is sourced from PubChem (CID 43228143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).