1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione

C15H18N2O3 — CID 13220404

IUPAC1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione
SMILESCOc1ccccc1N1C(=O)CC(N2CCCC2)C1=O
InChIInChI=1S/C15H18N2O3/c1-20-13-7-3-2-6-11(13)17-14(18)10-12(15(17)19)16-8-4-5-9-16/h2-3,6-7,12H,4-5,8-10H2,1H3
InChIKeyUMGDZOWBCVCWKK-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.42
Rot. Bonds3

About 1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione

1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione (PubChem CID 13220404) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione
PubChem CID13220404
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione
SMILESCOc1ccccc1N1C(=O)CC(N2CCCC2)C1=O
InChIInChI=1S/C15H18N2O3/c1-20-13-7-3-2-6-11(13)17-14(18)10-12(15(17)19)16-8-4-5-9-16/h2-3,6-7,12H,4-5,8-10H2,1H3
InChIKeyUMGDZOWBCVCWKK-UHFFFAOYSA-N
XLogP1.42
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[1-(2-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxylic acid
CID 16583901
(3S)-1-(2-methoxyphenyl)-3-(4-phenylpiperazin-1-yl)pyrrolidine-2,5-dione
CID 1087567
(3R)-3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(2-methylphenyl)pyrrolidine-2,5-dione
CID 2126419
ethyl (3S)-1-[(3R)-1-(2-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-3-carboxylate
CID 7341851
ethyl 1-[1-(2-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-3-carboxylate
CID 3754828
(3R)-1-(2,4-difluorophenyl)-3-[4-(2-methoxyphenyl)piperazin-1-yl]pyrrolidine-2,5-dione
CID 2107844
(3S)-1-(3,5-dichlorophenyl)-3-[4-(2-methoxyphenyl)piperazin-1-yl]pyrrolidine-2,5-dione
CID 1369612
(3S)-3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(3-methylphenyl)pyrrolidine-2,5-dione
CID 1213323
(3R)-3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(2-methoxyphenyl)pyrrolidine-2,5-dione
CID 1040904
3-[4-(2,3-dihydro-1,4-benzodioxine-3-carbonyl)piperazin-1-yl]-1-(2-methoxyphenyl)pyrrolidine-2,5-dione
CID 17337092
(3S)-1-(2-methoxyphenyl)-3-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)pyrrolidine-2,5-dione
CID 98300235
1-[1-(2-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]piperidine-4-carboxylic acid
CID 6471615

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione?
The IUPAC name of 1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione (CID 13220404) is 1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione?
The canonical SMILES for 1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione is COc1ccccc1N1C(=O)CC(N2CCCC2)C1=O.
What is the InChIKey of 1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione?
The InChIKey is UMGDZOWBCVCWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-20-13-7-3-2-6-11(13)17-14(18)10-12(15(17)19)16-8-4-5-9-16/h2-3,6-7,12H,4-5,8-10H2,1H3.
What are the key properties of 1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione?
1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione has a molecular weight of 274.32 g/mol, XLogP of 1.42, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-3-pyrrolidin-1-ylpyrrolidine-2,5-dione is sourced from PubChem (CID 13220404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).