N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide

C16H22N2O3 — CID 108523411

IUPACN-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide
SMILESCCOc1ccccc1NC(=O)C(=O)N1CCCCC1C
InChIInChI=1S/C16H22N2O3/c1-3-21-14-10-5-4-9-13(14)17-15(19)16(20)18-11-7-6-8-12(18)2/h4-5,9-10,12H,3,6-8,11H2,1-2H3,(H,17,19)
InChIKeyWKGXYCGFUTYJOP-UHFFFAOYSA-N
MW290.36 g/mol
LogP2.42
Rot. Bonds3

About N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide

N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide (PubChem CID 108523411) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide
PubChem CID108523411
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC NameN-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide
SMILESCCOc1ccccc1NC(=O)C(=O)N1CCCCC1C
InChIInChI=1S/C16H22N2O3/c1-3-21-14-10-5-4-9-13(14)17-15(19)16(20)18-11-7-6-8-12(18)2/h4-5,9-10,12H,3,6-8,11H2,1-2H3,(H,17,19)
InChIKeyWKGXYCGFUTYJOP-UHFFFAOYSA-N
XLogP2.42
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methylpiperidin-1-yl)-N-naphthalen-1-yl-2-oxoacetamide
CID 108523375
N-(2-ethoxyphenyl)-2-ethylpiperidine-1-carboxamide
CID 6468578
butyl 2-[[2-(2-methylpiperidin-1-yl)-2-oxoacetyl]amino]benzoate
CID 108514590
2-(2-ethoxyphenyl)-1-[(2R)-2-methylpiperidin-1-yl]ethanone
CID 134503396
N-cyclohexyl-N'-(2-ethoxyphenyl)oxamide
CID 7585382
N-[(2-ethoxyphenyl)methyl]-2-methylpiperidine-1-carboxamide
CID 47376286
(2R)-N-(2-ethoxyphenyl)-2-thiophen-2-ylazepane-1-carboxamide
CID 92503136
N-(2,5-dimethylphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide
CID 47336445
(4aS,8aS)-N-(2-ethoxyphenyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide
CID 51944761
N-(2-ethoxyphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056478
2-(2-ethylpiperidin-1-yl)-N-(2-methylphenyl)-2-oxoacetamide
CID 47336165
(2S)-N-(2-ethoxyphenyl)-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide
CID 95714167

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide (CID 108523411) is N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide is CCOc1ccccc1NC(=O)C(=O)N1CCCCC1C.
What is the InChIKey of N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide?
The InChIKey is WKGXYCGFUTYJOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-3-21-14-10-5-4-9-13(14)17-15(19)16(20)18-11-7-6-8-12(18)2/h4-5,9-10,12H,3,6-8,11H2,1-2H3,(H,17,19).
What are the key properties of N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide?
N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide has a molecular weight of 290.36 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide is sourced from PubChem (CID 108523411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).