3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione

C19H20N2O4 — CID 3367041

IUPAC3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione
SMILESCCOc1ccc(NC2CC(=O)N(c3ccc(OC)cc3)C2=O)cc1
InChIInChI=1S/C19H20N2O4/c1-3-25-16-8-4-13(5-9-16)20-17-12-18(22)21(19(17)23)14-6-10-15(24-2)11-7-14/h4-11,17,20H,3,12H2,1-2H3
InChIKeyDHSCNHZQWPVGAF-UHFFFAOYSA-N
MW340.38 g/mol
LogP2.84
Rot. Bonds6

About 3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione

3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione (PubChem CID 3367041) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione
PubChem CID3367041
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione
SMILESCCOc1ccc(NC2CC(=O)N(c3ccc(OC)cc3)C2=O)cc1
InChIInChI=1S/C19H20N2O4/c1-3-25-16-8-4-13(5-9-16)20-17-12-18(22)21(19(17)23)14-6-10-15(24-2)11-7-14/h4-11,17,20H,3,12H2,1-2H3
InChIKeyDHSCNHZQWPVGAF-UHFFFAOYSA-N
XLogP2.84
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

(3S)-3-(4-bromoanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione
CID 51860132
1-(4-iodophenyl)-3-(4-methoxyanilino)pyrrolidine-2,5-dione
CID 2877177
ethyl 4-[(3S)-3-(4-methoxyanilino)-2,5-dioxopyrrolidin-1-yl]benzoate
CID 1147346
(3S)-1-[4-(difluoromethylsulfanyl)phenyl]-3-(4-ethoxyanilino)pyrrolidine-2,5-dione
CID 2242272
1-(3,4-dichlorophenyl)-3-(4-ethoxyanilino)pyrrolidine-2,5-dione
CID 2877269
1-(2,4-dimethoxyphenyl)-3-(4-ethoxyanilino)pyrrolidine-2,5-dione
CID 22332764
(3S)-1-(4-methoxyphenyl)-3-(4-morpholin-4-ylanilino)pyrrolidine-2,5-dione
CID 986889
(3R)-1-(4-methoxyphenyl)-3-[4-(trifluoromethoxy)anilino]pyrrolidine-2,5-dione
CID 2058986
1-(4-ethoxyphenyl)-3-(3-fluoroanilino)pyrrolidine-2,5-dione
CID 43844693
(3R)-3-(4-methylanilino)-1-(4-propoxyphenyl)pyrrolidine-2,5-dione
CID 7025063
(3R)-3-(4-methoxyanilino)-1-(3-methoxyphenyl)pyrrolidine-2,5-dione
CID 691645
(3S)-3-(4-methylsulfanylanilino)-1-(4-propoxyphenyl)pyrrolidine-2,5-dione
CID 51659053

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione?
The IUPAC name of 3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione (CID 3367041) is 3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione?
The canonical SMILES for 3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione is CCOc1ccc(NC2CC(=O)N(c3ccc(OC)cc3)C2=O)cc1.
What is the InChIKey of 3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione?
The InChIKey is DHSCNHZQWPVGAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-3-25-16-8-4-13(5-9-16)20-17-12-18(22)21(19(17)23)14-6-10-15(24-2)11-7-14/h4-11,17,20H,3,12H2,1-2H3.
What are the key properties of 3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione?
3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione has a molecular weight of 340.38 g/mol, XLogP of 2.84, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxyanilino)-1-(4-methoxyphenyl)pyrrolidine-2,5-dione is sourced from PubChem (CID 3367041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).