3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one

C20H24N2O4 — CID 72865730

IUPAC3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one
SMILESCOc1cccn(CC(=O)N2CCCC(OCc3ccccc3)C2)c1=O
InChIInChI=1S/C20H24N2O4/c1-25-18-10-6-12-22(20(18)24)14-19(23)21-11-5-9-17(13-21)26-15-16-7-3-2-4-8-16/h2-4,6-8,10,12,17H,5,9,11,13-15H2,1H3
InChIKeyFRZGDEDZONMAQQ-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.06
Rot. Bonds6

About 3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one

3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one (PubChem CID 72865730) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one.

Molecular Properties

Compound Name3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one
PubChem CID72865730
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one
SMILESCOc1cccn(CC(=O)N2CCCC(OCc3ccccc3)C2)c1=O
InChIInChI=1S/C20H24N2O4/c1-25-18-10-6-12-22(20(18)24)14-19(23)21-11-5-9-17(13-21)26-15-16-7-3-2-4-8-16/h2-4,6-8,10,12,17H,5,9,11,13-15H2,1H3
InChIKeyFRZGDEDZONMAQQ-UHFFFAOYSA-N
XLogP2.06
TPSA60.77 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-1-[2-[(3S)-3-(methylsulfonylmethyl)piperidin-1-yl]-2-oxoethyl]pyridin-2-one
CID 97283001
3-methoxy-1-(2-oxo-2-thiomorpholin-4-ylethyl)pyridin-2-one
CID 72931086
3-methoxy-1-[2-[(1R,5S)-8-methoxy-3-azabicyclo[3.2.1]octan-3-yl]-2-oxoethyl]pyridin-2-one
CID 72904852
3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one
CID 97283444
6-methyl-1-[3-oxo-3-(3-phenylmethoxypiperidin-1-yl)propyl]pyridin-2-one
CID 74232921
2-methoxy-1-[(3S)-3-(3-phenylmethoxyazetidine-1-carbonyl)piperidin-1-yl]ethanone
CID 97208983
1-[2-[(2S)-2-(2-aminoethyl)morpholin-4-yl]-2-oxoethyl]-3-methoxypyridin-2-one
CID 97284852
4-phenylmethoxyazepane-1-carboxylic acid
CID 77320736
3-methoxy-1-[2-(9-oxa-2-azaspiro[5.5]undecan-2-yl)-2-oxoethyl]pyridin-2-one
CID 72884824
5-benzyl-5-[3-oxo-3-(3-phenylmethoxypiperidin-1-yl)propyl]pyrrolidin-2-one
CID 45218860
1-(2-methoxyphenyl)-4-methyl-3-[3-(pyridin-3-ylmethoxy)piperidine-1-carbonyl]pyridin-2-one
CID 172660066
(2-fluorophenyl)-[3-[(4-fluorophenyl)methoxy]piperidin-1-yl]methanone
CID 42844111

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one?
The IUPAC name of 3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one (CID 72865730) is 3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one.
What is the SMILES notation for 3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one?
The canonical SMILES for 3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one is COc1cccn(CC(=O)N2CCCC(OCc3ccccc3)C2)c1=O.
What is the InChIKey of 3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one?
The InChIKey is FRZGDEDZONMAQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-25-18-10-6-12-22(20(18)24)14-19(23)21-11-5-9-17(13-21)26-15-16-7-3-2-4-8-16/h2-4,6-8,10,12,17H,5,9,11,13-15H2,1H3.
What are the key properties of 3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one?
3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one has a molecular weight of 356.42 g/mol, XLogP of 2.06, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one is sourced from PubChem (CID 72865730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).