1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione

C15H20N2O4 — CID 60933482

IUPAC1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione
SMILESCCN1C(=O)CC(Nc2cccc(OCCOC)c2)C1=O
InChIInChI=1S/C15H20N2O4/c1-3-17-14(18)10-13(15(17)19)16-11-5-4-6-12(9-11)21-8-7-20-2/h4-6,9,13,16H,3,7-8,10H2,1-2H3
InChIKeyBGJHNFYIAPHOPE-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.27
Rot. Bonds7

About 1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione

1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione (PubChem CID 60933482) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is 1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione
PubChem CID60933482
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione
SMILESCCN1C(=O)CC(Nc2cccc(OCCOC)c2)C1=O
InChIInChI=1S/C15H20N2O4/c1-3-17-14(18)10-13(15(17)19)16-11-5-4-6-12(9-11)21-8-7-20-2/h4-6,9,13,16H,3,7-8,10H2,1-2H3
InChIKeyBGJHNFYIAPHOPE-UHFFFAOYSA-N
XLogP1.27
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-3-[4-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione
CID 47030349
N-ethyl-2-[3-[(1-ethyl-2,5-dioxopyrrolidin-3-yl)amino]phenoxy]acetamide
CID 47062044
3-[3-(dimethylamino)anilino]-1-ethylpyrrolidine-2,5-dione
CID 115377431
N-cyclopropyl-3-(2-methoxyethoxy)aniline
CID 103439187
1-ethyl-3-[(6-methoxy-3-pyridinyl)amino]pyrrolidine-2,5-dione
CID 43636158
(3S)-3-(3,4-dimethylanilino)-1-ethylpyrrolidine-2,5-dione
CID 894359
N-[3-(2-methoxyethoxy)phenyl]cycloheptanamine
CID 54864785
(3S)-1-ethyl-3-[3-(pyrazol-1-ylmethyl)anilino]pyrrolidine-2,5-dione
CID 98419532
3-(2-ethoxyanilino)-1-ethylpyrrolidine-2,5-dione
CID 43411500
1-[4-[3-(2-methoxyethoxy)anilino]piperidin-1-yl]ethanone
CID 60936422
3-(2-methoxyethoxy)-N-pentan-3-ylaniline
CID 54864774
N-[3-(2-methoxyethoxy)phenyl]pyrrolidin-3-amine
CID 79731567

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione?
The IUPAC name of 1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione (CID 60933482) is 1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione?
The canonical SMILES for 1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione is CCN1C(=O)CC(Nc2cccc(OCCOC)c2)C1=O.
What is the InChIKey of 1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione?
The InChIKey is BGJHNFYIAPHOPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-3-17-14(18)10-13(15(17)19)16-11-5-4-6-12(9-11)21-8-7-20-2/h4-6,9,13,16H,3,7-8,10H2,1-2H3.
What are the key properties of 1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione?
1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione has a molecular weight of 292.34 g/mol, XLogP of 1.27, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[3-(2-methoxyethoxy)anilino]pyrrolidine-2,5-dione is sourced from PubChem (CID 60933482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).