N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide

C15H18N2O3 — CID 2194073

IUPACN-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide
SMILESCC(=O)c1cccc(NC(=O)C(=O)N2CCCCC2)c1
InChIInChI=1S/C15H18N2O3/c1-11(18)12-6-5-7-13(10-12)16-14(19)15(20)17-8-3-2-4-9-17/h5-7,10H,2-4,8-9H2,1H3,(H,16,19)
InChIKeyBNGIMRCMLXHNTR-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.84
Rot. Bonds2

About N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide

N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide (PubChem CID 2194073) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide
PubChem CID2194073
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC NameN-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide
SMILESCC(=O)c1cccc(NC(=O)C(=O)N2CCCCC2)c1
InChIInChI=1S/C15H18N2O3/c1-11(18)12-6-5-7-13(10-12)16-14(19)15(20)17-8-3-2-4-9-17/h5-7,10H,2-4,8-9H2,1H3,(H,16,19)
InChIKeyBNGIMRCMLXHNTR-UHFFFAOYSA-N
XLogP1.84
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.84
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

N-(3-acetylphenyl)-2-(3,5-dimethylpiperidin-1-yl)-2-oxoacetamide
CID 108514940
2-(azepan-1-yl)-N-(3-chlorophenyl)-2-oxoacetamide
CID 47335488
N-(3-acetylphenyl)-3-oxo-3-piperidin-1-ylpropanamide
CID 108942443
N-(3-acetylphenyl)-2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoacetamide
CID 108515042
N-(3-acetylphenyl)-2,2-dimethyl-3-oxo-3-piperidin-1-ylpropanamide
CID 108958859
N-(3-acetylphenyl)-3-(azepane-1-carbonyl)benzamide
CID 109056722
(3R)-1-[(3-acetylphenyl)carbamoyl]piperidine-3-carboxylic acid
CID 28512783
(2R)-N-(3-acetylphenyl)-2-piperidin-1-ylpropanamide
CID 8894791
1-(3-acetylphenyl)-3-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]urea
CID 94819026
[(2S)-1-(3-acetylanilino)-1-oxopropan-2-yl] pyrrolidine-1-carbodithioate
CID 7583965
N-[4-[(3-acetylphenyl)sulfamoyl]phenyl]piperidine-1-carboxamide
CID 2985508
N-(3-acetylphenyl)-2-(azepane-1-carbonyl)pyridine-4-carboxamide
CID 109090775

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide?
The IUPAC name of N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide (CID 2194073) is N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide is CC(=O)c1cccc(NC(=O)C(=O)N2CCCCC2)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide?
The InChIKey is BNGIMRCMLXHNTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-11(18)12-6-5-7-13(10-12)16-14(19)15(20)17-8-3-2-4-9-17/h5-7,10H,2-4,8-9H2,1H3,(H,16,19).
What are the key properties of N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide?
N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide has a molecular weight of 274.32 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-oxo-2-piperidin-1-ylacetamide is sourced from PubChem (CID 2194073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).