2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide

C17H24N2O2 — CID 108522285

IUPAC2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide
SMILESCCc1ccc(NC(=O)C(=O)N2C(C)CCCC2C)cc1
InChIInChI=1S/C17H24N2O2/c1-4-14-8-10-15(11-9-14)18-16(20)17(21)19-12(2)6-5-7-13(19)3/h8-13H,4-7H2,1-3H3,(H,18,20)
InChIKeyFVZKTIMFDCFMNF-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.98
Rot. Bonds2

About 2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide

2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide (PubChem CID 108522285) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide.

Molecular Properties

Compound Name2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide
PubChem CID108522285
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide
SMILESCCc1ccc(NC(=O)C(=O)N2C(C)CCCC2C)cc1
InChIInChI=1S/C17H24N2O2/c1-4-14-8-10-15(11-9-14)18-16(20)17(21)19-12(2)6-5-7-13(19)3/h8-13H,4-7H2,1-3H3,(H,18,20)
InChIKeyFVZKTIMFDCFMNF-UHFFFAOYSA-N
XLogP2.98
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

ethyl 4-[[2-(2,6-dimethylpiperidin-1-yl)-2-oxoacetyl]amino]benzoate
CID 108500096
N-(4-anilinophenyl)-2-(2,6-dimethylpiperidin-1-yl)-2-oxoacetamide
CID 108524855
N-(4-cyanophenyl)-2-(2,6-dimethylpiperidin-1-yl)-2-oxoacetamide
CID 108519434
N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide
CID 108522277
N-(3-chlorophenyl)-2-(2,6-dimethylpiperidin-1-yl)-2-oxoacetamide
CID 108516493
N-(4-ethylphenyl)-2-[(2S)-2-methylpyrrolidin-1-yl]acetamide
CID 95774756
N-(4-ethylphenyl)-2-[3-(hydroxymethyl)piperidin-1-yl]-2-oxoacetamide
CID 111797796
N'-(4-ethylphenyl)-N-(4-methylcyclohexyl)oxamide
CID 124506867
N-[(4-chlorophenyl)methyl]-2-(2,6-dimethylpiperidin-1-yl)-2-oxoacetamide
CID 108507737
cis-(1R,2S)-2-[(4-ethylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 853832
(2S,6R)-N-(4-aminophenyl)-2,6-dimethylpiperidine-1-carboxamide
CID 93056889
N-cycloheptyl-N'-(4-ethylphenyl)propanediamide
CID 108951571

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide?
The IUPAC name of 2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide (CID 108522285) is 2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide.
What is the SMILES notation for 2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide?
The canonical SMILES for 2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide is CCc1ccc(NC(=O)C(=O)N2C(C)CCCC2C)cc1.
What is the InChIKey of 2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide?
The InChIKey is FVZKTIMFDCFMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-4-14-8-10-15(11-9-14)18-16(20)17(21)19-12(2)6-5-7-13(19)3/h8-13H,4-7H2,1-3H3,(H,18,20).
What are the key properties of 2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide?
2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide has a molecular weight of 288.39 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylpiperidin-1-yl)-N-(4-ethylphenyl)-2-oxoacetamide is sourced from PubChem (CID 108522285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).