3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione

C20H19N3O3 — CID 4195139

IUPAC3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione
SMILESCC1(c2ccccc2)NC(=O)N(CC(=O)N2CCc3ccccc32)C1=O
InChIInChI=1S/C20H19N3O3/c1-20(15-8-3-2-4-9-15)18(25)23(19(26)21-20)13-17(24)22-12-11-14-7-5-6-10-16(14)22/h2-10H,11-13H2,1H3,(H,21,26)
InChIKeyDABUQMFIKQKBNG-UHFFFAOYSA-N
MW349.39 g/mol
LogP2.04
Rot. Bonds3

About 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione

3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione (PubChem CID 4195139) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione
PubChem CID4195139
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC Name3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione
SMILESCC1(c2ccccc2)NC(=O)N(CC(=O)N2CCc3ccccc32)C1=O
InChIInChI=1S/C20H19N3O3/c1-20(15-8-3-2-4-9-15)18(25)23(19(26)21-20)13-17(24)22-12-11-14-7-5-6-10-16(14)22/h2-10H,11-13H2,1H3,(H,21,26)
InChIKeyDABUQMFIKQKBNG-UHFFFAOYSA-N
XLogP2.04
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione?
The IUPAC name of 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione (CID 4195139) is 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione is CC1(c2ccccc2)NC(=O)N(CC(=O)N2CCc3ccccc32)C1=O.
What is the InChIKey of 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione?
The InChIKey is DABUQMFIKQKBNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c1-20(15-8-3-2-4-9-15)18(25)23(19(26)21-20)13-17(24)22-12-11-14-7-5-6-10-16(14)22/h2-10H,11-13H2,1H3,(H,21,26).
What are the key properties of 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione?
3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione has a molecular weight of 349.39 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 4195139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).