N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide

C15H20N2O3 — CID 108517303

IUPACN-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide
SMILESCOc1ccccc1CNC(=O)C(=O)N1CCCCC1
InChIInChI=1S/C15H20N2O3/c1-20-13-8-4-3-7-12(13)11-16-14(18)15(19)17-9-5-2-6-10-17/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,16,18)
InChIKeyMLBOSEDCKSPFCG-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.32
Rot. Bonds3

About N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide

N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide (PubChem CID 108517303) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide
PubChem CID108517303
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide
SMILESCOc1ccccc1CNC(=O)C(=O)N1CCCCC1
InChIInChI=1S/C15H20N2O3/c1-20-13-8-4-3-7-12(13)11-16-14(18)15(19)17-9-5-2-6-10-17/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,16,18)
InChIKeyMLBOSEDCKSPFCG-UHFFFAOYSA-N
XLogP1.32
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.32
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-[(2-methoxyphenyl)methyl]pyrrolidine-1-carboxamide
CID 38150329
4-(azepane-1-carbonyl)-N-[(2-methoxyphenyl)methyl]benzamide
CID 109047377
N-[(2-fluorophenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide
CID 108517300
1-[3-(azepan-1-yl)-3-oxopropyl]-3-[(2-methoxyphenyl)methyl]urea
CID 52810254
2-(azocan-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 51170947
1-(azepan-1-yl)-2-[(2-methoxyphenyl)methylamino]ethanone
CID 28570429
N-[(2-methoxyphenyl)methyl]-3-(piperidine-1-carbonyl)benzamide
CID 109051991
2-[(2-methoxyphenyl)methylamino]-1-pyrrolidin-1-ylethanone
CID 28570278
N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide
CID 8901770
N-(2-methoxyphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide
CID 550974
[(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl] pyrrolidine-1-carbodithioate
CID 8539506
(3S)-3-N-[(2-methoxyphenyl)methyl]-1-N-phenylpiperidine-1,3-dicarboxamide
CID 9083501

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide (CID 108517303) is N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide is COc1ccccc1CNC(=O)C(=O)N1CCCCC1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide?
The InChIKey is MLBOSEDCKSPFCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-20-13-8-4-3-7-12(13)11-16-14(18)15(19)17-9-5-2-6-10-17/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,16,18).
What are the key properties of N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide?
N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide has a molecular weight of 276.34 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-2-oxo-2-piperidin-1-ylacetamide is sourced from PubChem (CID 108517303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).