3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione

C20H20N2O2 — CID 3152006

IUPAC3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione
SMILESCCc1ccccc1N1C(=O)CC(N2CCc3ccccc32)C1=O
InChIInChI=1S/C20H20N2O2/c1-2-14-7-3-6-10-17(14)22-19(23)13-18(20(22)24)21-12-11-15-8-4-5-9-16(15)21/h3-10,18H,2,11-13H2,1H3
InChIKeyNDMDOKGXTXLLFZ-UHFFFAOYSA-N
MW320.39 g/mol
LogP2.94
Rot. Bonds3

About 3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione

3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione (PubChem CID 3152006) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione
PubChem CID3152006
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione
SMILESCCc1ccccc1N1C(=O)CC(N2CCc3ccccc32)C1=O
InChIInChI=1S/C20H20N2O2/c1-2-14-7-3-6-10-17(14)22-19(23)13-18(20(22)24)21-12-11-15-8-4-5-9-16(15)21/h3-10,18H,2,11-13H2,1H3
InChIKeyNDMDOKGXTXLLFZ-UHFFFAOYSA-N
XLogP2.94
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione?
The IUPAC name of 3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione (CID 3152006) is 3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione?
The canonical SMILES for 3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione is CCc1ccccc1N1C(=O)CC(N2CCc3ccccc32)C1=O.
What is the InChIKey of 3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione?
The InChIKey is NDMDOKGXTXLLFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-2-14-7-3-6-10-17(14)22-19(23)13-18(20(22)24)21-12-11-15-8-4-5-9-16(15)21/h3-10,18H,2,11-13H2,1H3.
What are the key properties of 3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione?
3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione has a molecular weight of 320.39 g/mol, XLogP of 2.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydroindol-1-yl)-1-(2-ethylphenyl)pyrrolidine-2,5-dione is sourced from PubChem (CID 3152006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).