3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide

C20H21N3O3 — CID 110677266

IUPAC3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide
SMILESCCN(C(=O)CCC1(c2ccccc2)NC(=O)NC1=O)c1ccccc1
InChIInChI=1S/C20H21N3O3/c1-2-23(16-11-7-4-8-12-16)17(24)13-14-20(15-9-5-3-6-10-15)18(25)21-19(26)22-20/h3-12H,2,13-14H2,1H3,(H2,21,22,25,26)
InChIKeyYHCRMCXQRXAMNO-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.55
Rot. Bonds6

About 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide

3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide (PubChem CID 110677266) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide.

Molecular Properties

Compound Name3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide
PubChem CID110677266
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC Name3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide
SMILESCCN(C(=O)CCC1(c2ccccc2)NC(=O)NC1=O)c1ccccc1
InChIInChI=1S/C20H21N3O3/c1-2-23(16-11-7-4-8-12-16)17(24)13-14-20(15-9-5-3-6-10-15)18(25)21-19(26)22-20/h3-12H,2,13-14H2,1H3,(H2,21,22,25,26)
InChIKeyYHCRMCXQRXAMNO-UHFFFAOYSA-N
XLogP2.55
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide?
The IUPAC name of 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide (CID 110677266) is 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide.
What is the SMILES notation for 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide?
The canonical SMILES for 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide is CCN(C(=O)CCC1(c2ccccc2)NC(=O)NC1=O)c1ccccc1.
What is the InChIKey of 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide?
The InChIKey is YHCRMCXQRXAMNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-2-23(16-11-7-4-8-12-16)17(24)13-14-20(15-9-5-3-6-10-15)18(25)21-19(26)22-20/h3-12H,2,13-14H2,1H3,(H2,21,22,25,26).
What are the key properties of 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide?
3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide has a molecular weight of 351.41 g/mol, XLogP of 2.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-ethyl-N-phenylpropanamide is sourced from PubChem (CID 110677266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).