1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone

C15H21NO2 — CID 61399838

IUPAC1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone
SMILESCCC1CCCCN1C(=O)Cc1cccc(O)c1
InChIInChI=1S/C15H21NO2/c1-2-13-7-3-4-9-16(13)15(18)11-12-6-5-8-14(17)10-12/h5-6,8,10,13,17H,2-4,7,9,11H2,1H3
InChIKeyOOGXKKDVJXAVJI-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.73
Rot. Bonds3

About 1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone

1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone (PubChem CID 61399838) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone.

Molecular Properties

Compound Name1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone
PubChem CID61399838
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone
SMILESCCC1CCCCN1C(=O)Cc1cccc(O)c1
InChIInChI=1S/C15H21NO2/c1-2-13-7-3-4-9-16(13)15(18)11-12-6-5-8-14(17)10-12/h5-6,8,10,13,17H,2-4,7,9,11H2,1H3
InChIKeyOOGXKKDVJXAVJI-UHFFFAOYSA-N
XLogP2.73
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-aminophenyl)-1-(2-ethylpiperidin-1-yl)ethanone
CID 62498346
2-(3-hydroxyphenyl)-1-[2-(2-hydroxypropyl)azepan-1-yl]ethanone
CID 79540436
1-[2-(bromomethyl)pyrrolidin-1-yl]-2-(3-hydroxyphenyl)ethanone
CID 80678156
2-(3-hydroxyphenyl)-1-(2-methylpyrrolidin-1-yl)ethanone
CID 61400367
methyl (2R)-1-[2-(3-hydroxyphenyl)acetyl]piperidine-2-carboxylate
CID 115535987
2-[1-[2-(3-hydroxyphenyl)acetyl]pyrrolidin-2-yl]-1-phenylethanone
CID 86785890
1-(2-ethylazepan-1-yl)-2-(2-hydroxyphenyl)ethanone
CID 112695780
1-[2-(aminomethyl)azepan-1-yl]-2-(3-methylphenyl)ethanone
CID 116639946
1-(5-ethyl-2-methylmorpholin-4-yl)-2-(3-hydroxyphenyl)ethanone
CID 61424310
1-[2-(hydroxymethyl)piperidin-1-yl]-2-(3-methoxyphenyl)ethanone
CID 43421553
1-(3-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone
CID 61399726
benzyl 4-(2-ethylpiperidin-1-yl)-4-oxobutanoate
CID 138554546

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone?
The IUPAC name of 1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone (CID 61399838) is 1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone.
What is the SMILES notation for 1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone?
The canonical SMILES for 1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone is CCC1CCCCN1C(=O)Cc1cccc(O)c1.
What is the InChIKey of 1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone?
The InChIKey is OOGXKKDVJXAVJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-2-13-7-3-4-9-16(13)15(18)11-12-6-5-8-14(17)10-12/h5-6,8,10,13,17H,2-4,7,9,11H2,1H3.
What are the key properties of 1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone?
1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone has a molecular weight of 247.34 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylpiperidin-1-yl)-2-(3-hydroxyphenyl)ethanone is sourced from PubChem (CID 61399838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).