1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone

C15H23NO2S — CID 62050766

IUPAC1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone
SMILESCCc1ccc(C(=O)CN2CCCCC2CCO)s1
InChIInChI=1S/C15H23NO2S/c1-2-13-6-7-15(19-13)14(18)11-16-9-4-3-5-12(16)8-10-17/h6-7,12,17H,2-5,8-11H2,1H3
InChIKeyXSDATSAFYVSQMJ-UHFFFAOYSA-N
MW281.42 g/mol
LogP2.73
Rot. Bonds6

About 1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone

1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone (PubChem CID 62050766) has the molecular formula C15H23NO2S and a molecular weight of 281.42 g/mol. Its IUPAC name is 1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone
PubChem CID62050766
Molecular FormulaC15H23NO2S
Molecular Weight281.42 g/mol
Exact Mass281.14
IUPAC Name1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone
SMILESCCc1ccc(C(=O)CN2CCCCC2CCO)s1
InChIInChI=1S/C15H23NO2S/c1-2-13-6-7-15(19-13)14(18)11-16-9-4-3-5-12(16)8-10-17/h6-7,12,17H,2-5,8-11H2,1H3
InChIKeyXSDATSAFYVSQMJ-UHFFFAOYSA-N
XLogP2.73
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.42
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(5-ethylthiophen-2-yl)-2-oxoethyl]-N-methylpiperidine-2-carboxamide
CID 62037634
1-(5-ethylthiophen-2-yl)-2-pyrrolidin-1-ylethanone
CID 43227597
1-(5-chlorothiophen-2-yl)-2-(2-ethylpiperidin-1-yl)ethanone
CID 4014587
5-[[2-(2-hydroxyethyl)piperidin-1-yl]methyl]thiophene-2-carbohydrazide
CID 55214588
1-(5-chlorothiophen-2-yl)-2-(2-ethylazepan-1-yl)ethanone
CID 104690747
1-(4-aminophenyl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone
CID 82256579
2-(4-cyclopropylpiperazin-1-yl)-1-(5-ethylthiophen-2-yl)ethanone
CID 61445237
2-(2-chloroethyl)-1-[(5-ethylthiophen-2-yl)methyl]piperidine
CID 63386907
2-[(2S)-1-ethylpiperidin-2-yl]ethanol
CID 26365884
1-(5-ethylthiophen-2-yl)-2-(4-methylsulfanylpiperidin-1-yl)ethanone
CID 114237526
N-ethyl-2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-phenylacetamide
CID 60690329
2-(5-ethyl-2-methylmorpholin-4-yl)-1-(5-ethylthiophen-2-yl)ethanone
CID 60680300

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone?
The IUPAC name of 1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone (CID 62050766) is 1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone.
What is the SMILES notation for 1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone?
The canonical SMILES for 1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone is CCc1ccc(C(=O)CN2CCCCC2CCO)s1.
What is the InChIKey of 1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone?
The InChIKey is XSDATSAFYVSQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2S/c1-2-13-6-7-15(19-13)14(18)11-16-9-4-3-5-12(16)8-10-17/h6-7,12,17H,2-5,8-11H2,1H3.
What are the key properties of 1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone?
1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone has a molecular weight of 281.42 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylthiophen-2-yl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone is sourced from PubChem (CID 62050766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).