3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one

C16H24N2O4 — CID 97283444

IUPAC3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one
SMILESCCCOC[C@H]1CCN(C(=O)Cn2cccc(OC)c2=O)C1
InChIInChI=1S/C16H24N2O4/c1-3-9-22-12-13-6-8-17(10-13)15(19)11-18-7-4-5-14(21-2)16(18)20/h4-5,7,13H,3,6,8-12H2,1-2H3/t13-/m0/s1
InChIKeyUMWJOPBWPBWDBX-ZDUSSCGKSA-N
MW308.38 g/mol
LogP1.13
Rot. Bonds7

About 3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one

3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one (PubChem CID 97283444) has the molecular formula C16H24N2O4 and a molecular weight of 308.38 g/mol. Its IUPAC name is 3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one.

Molecular Properties

Compound Name3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one
PubChem CID97283444
Molecular FormulaC16H24N2O4
Molecular Weight308.38 g/mol
Exact Mass308.17
IUPAC Name3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one
SMILESCCCOC[C@H]1CCN(C(=O)Cn2cccc(OC)c2=O)C1
InChIInChI=1S/C16H24N2O4/c1-3-9-22-12-13-6-8-17(10-13)15(19)11-18-7-4-5-14(21-2)16(18)20/h4-5,7,13H,3,6,8-12H2,1-2H3/t13-/m0/s1
InChIKeyUMWJOPBWPBWDBX-ZDUSSCGKSA-N
XLogP1.13
TPSA60.77 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methoxy-1-[2-[(3S)-3-(methylsulfonylmethyl)piperidin-1-yl]-2-oxoethyl]pyridin-2-one
CID 97283001
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-thiomorpholin-4-ylethyl)pyridin-2-one
CID 72931086
1-[2-[(2S)-2-(2-aminoethyl)morpholin-4-yl]-2-oxoethyl]-3-methoxypyridin-2-one
CID 97284852
3-methyl-1-[2-oxo-2-[3-(propoxymethyl)pyrrolidin-1-yl]ethyl]quinoxalin-2-one
CID 72913220
1-[2-oxo-2-[3-(propoxymethyl)pyrrolidin-1-yl]ethyl]-3,4-dihydroquinolin-2-one
CID 72928258
3-methoxy-1-[2-oxo-2-(3-phenylmethoxypiperidin-1-yl)ethyl]pyridin-2-one
CID 72865730
1-[2-[(3aS,6aS)-3,3a,4,5,6,6a-hexahydro-2H-pyrrolo[2,3-c]pyrrol-1-yl]-2-oxoethyl]-3-methoxypyridin-2-one;hydrochloride
CID 154899860
1-ethyl-6-methyl-3-[(3R)-3-(propoxymethyl)pyrrolidine-1-carbonyl]pyridin-2-one
CID 126448084
3-methoxy-1-[2-[(2R)-2-(3-methoxypropyl)piperidin-1-yl]-2-oxoethyl]pyridin-2-one
CID 97281858
3-methoxy-1-[2-[(2R)-2-(3-methoxyphenyl)azetidin-1-yl]-2-oxoethyl]pyridin-2-one
CID 97269461
4-[2-(3-methoxy-2-oxo-1-pyridinyl)acetyl]-1-(3-methoxyphenyl)piperazin-2-one
CID 72901150

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one?
The IUPAC name of 3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one (CID 97283444) is 3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one.
What is the SMILES notation for 3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one?
The canonical SMILES for 3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one is CCCOC[C@H]1CCN(C(=O)Cn2cccc(OC)c2=O)C1.
What is the InChIKey of 3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one?
The InChIKey is UMWJOPBWPBWDBX-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H24N2O4/c1-3-9-22-12-13-6-8-17(10-13)15(19)11-18-7-4-5-14(21-2)16(18)20/h4-5,7,13H,3,6,8-12H2,1-2H3/t13-/m0/s1.
What are the key properties of 3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one?
3-methoxy-1-[2-oxo-2-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one has a molecular weight of 308.38 g/mol, XLogP of 1.13, 7 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-[(3S)-3-(propoxymethyl)pyrrolidin-1-yl]ethyl]pyridin-2-one is sourced from PubChem (CID 97283444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).