1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide

C16H22N2O3 — CID 62037237

IUPAC1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide
SMILESCCOc1ccccc1C(=O)CN1CCCCC1C(N)=O
InChIInChI=1S/C16H22N2O3/c1-2-21-15-9-4-3-7-12(15)14(19)11-18-10-6-5-8-13(18)16(17)20/h3-4,7,9,13H,2,5-6,8,10-11H2,1H3,(H2,17,20)
InChIKeyLHIZEROBIFLKRE-UHFFFAOYSA-N
MW290.36 g/mol
LogP1.61
Rot. Bonds6

About 1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide

1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide (PubChem CID 62037237) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide
PubChem CID62037237
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide
SMILESCCOc1ccccc1C(=O)CN1CCCCC1C(N)=O
InChIInChI=1S/C16H22N2O3/c1-2-21-15-9-4-3-7-12(15)14(19)11-18-10-6-5-8-13(18)16(17)20/h3-4,7,9,13H,2,5-6,8,10-11H2,1H3,(H2,17,20)
InChIKeyLHIZEROBIFLKRE-UHFFFAOYSA-N
XLogP1.61
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-ethoxyphenyl)-2-[2-(hydroxymethyl)azepan-1-yl]ethanone
CID 116635347
[2-[(2R)-2-carbamoylpiperidin-1-yl]-2-oxoethyl] 2-ethoxybenzoate
CID 9197434
1-phenacylpiperidine-2-carboxamide
CID 60681003
1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide
CID 60681090
1-(2-oxo-2-thiophen-2-ylethyl)piperidine-2-carboxamide
CID 60680965
1-(2-ethoxyphenyl)-2-(4-methoxypiperidin-1-yl)ethanone
CID 43796226
2-cyclopentyl-1-(2-ethoxyphenyl)ethanone
CID 115533350
1-[2-(4-methylphenyl)-2-oxoethyl]piperidine-2-carboxamide
CID 60680985
2-cyclohexylsulfanyl-1-(2-ethoxyphenyl)ethanone
CID 60884096
1-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]piperidine-2-carboxamide
CID 60677071
1-[2-(4-methylsulfanylphenyl)-2-oxoethyl]piperidine-2-carboxamide
CID 60680989
4-[2-(2-ethoxyphenyl)-2-oxoethyl]-3-ethylpiperazin-2-one
CID 63601149

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide?
The IUPAC name of 1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide (CID 62037237) is 1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide.
What is the SMILES notation for 1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide?
The canonical SMILES for 1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide is CCOc1ccccc1C(=O)CN1CCCCC1C(N)=O.
What is the InChIKey of 1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide?
The InChIKey is LHIZEROBIFLKRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-2-21-15-9-4-3-7-12(15)14(19)11-18-10-6-5-8-13(18)16(17)20/h3-4,7,9,13H,2,5-6,8,10-11H2,1H3,(H2,17,20).
What are the key properties of 1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide?
1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide has a molecular weight of 290.36 g/mol, XLogP of 1.61, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide is sourced from PubChem (CID 62037237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).