N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide

C17H24N2O2 — CID 108522277

IUPACN-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide
SMILESCCc1ccc(NC(=O)C(=O)N2CCCCC2CC)cc1
InChIInChI=1S/C17H24N2O2/c1-3-13-8-10-14(11-9-13)18-16(20)17(21)19-12-6-5-7-15(19)4-2/h8-11,15H,3-7,12H2,1-2H3,(H,18,20)
InChIKeyMRJACSHHGSDYNN-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.98
Rot. Bonds3

About N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide

N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide (PubChem CID 108522277) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide
PubChem CID108522277
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide
SMILESCCc1ccc(NC(=O)C(=O)N2CCCCC2CC)cc1
InChIInChI=1S/C17H24N2O2/c1-3-13-8-10-14(11-9-13)18-16(20)17(21)19-12-6-5-7-15(19)4-2/h8-11,15H,3-7,12H2,1-2H3,(H,18,20)
InChIKeyMRJACSHHGSDYNN-UHFFFAOYSA-N
XLogP2.98
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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

2-(2-ethylpiperidin-1-yl)-N-(4-fluorophenyl)-2-oxoacetamide
CID 47336169
N-(4-anilinophenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide
CID 108523479
ethyl 4-[[2-(2-ethylpiperidin-1-yl)-2-oxoacetyl]amino]benzoate
CID 108500088
2-(2-ethylpiperidin-1-yl)-N-(4-nitrophenyl)-2-oxoacetamide
CID 108513142
N-(3,4-diethoxyphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide
CID 108519859
2-(2-ethylpiperidin-1-yl)-N-(2-methylphenyl)-2-oxoacetamide
CID 47336165
N-[4-(aminomethyl)phenyl]-2-ethylazepane-1-carboxamide
CID 104690862
2-(2-ethylpiperidin-1-yl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-oxoacetamide
CID 108523560
2-(2-ethylpiperidin-1-yl)-2-oxo-N-pyrimidin-2-ylacetamide
CID 108520691
N-(4-ethylphenyl)-2-(2-ethylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109090223
N-(4-chlorophenyl)-2-ethylpiperidine-1-carboxamide
CID 3111956
N-[2-(4-chlorophenyl)ethyl]-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide
CID 108985796

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide?
The IUPAC name of N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide (CID 108522277) is N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide?
The canonical SMILES for N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide is CCc1ccc(NC(=O)C(=O)N2CCCCC2CC)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide?
The InChIKey is MRJACSHHGSDYNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-3-13-8-10-14(11-9-13)18-16(20)17(21)19-12-6-5-7-15(19)4-2/h8-11,15H,3-7,12H2,1-2H3,(H,18,20).
What are the key properties of N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide?
N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide has a molecular weight of 288.39 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide is sourced from PubChem (CID 108522277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).