N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide

C19H19N3O3 — CID 110677217

IUPACN-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide
SMILESO=C(CCC1(c2ccccc2)NC(=O)NC1=O)NCc1ccccc1
InChIInChI=1S/C19H19N3O3/c23-16(20-13-14-7-3-1-4-8-14)11-12-19(15-9-5-2-6-10-15)17(24)21-18(25)22-19/h1-10H,11-13H2,(H,20,23)(H2,21,22,24,25)
InChIKeyRUBXSGLQQASDOW-UHFFFAOYSA-N
MW337.38 g/mol
LogP1.82
Rot. Bonds6

About N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide

N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide (PubChem CID 110677217) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide.

Molecular Properties

Compound NameN-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide
PubChem CID110677217
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC NameN-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide
SMILESO=C(CCC1(c2ccccc2)NC(=O)NC1=O)NCc1ccccc1
InChIInChI=1S/C19H19N3O3/c23-16(20-13-14-7-3-1-4-8-14)11-12-19(15-9-5-2-6-10-15)17(24)21-18(25)22-19/h1-10H,11-13H2,(H,20,23)(H2,21,22,24,25)
InChIKeyRUBXSGLQQASDOW-UHFFFAOYSA-N
XLogP1.82
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 51.82
H-Bond Donors ≤ 53
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 N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide?
The IUPAC name of N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide (CID 110677217) is N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide.
What is the SMILES notation for N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide?
The canonical SMILES for N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide is O=C(CCC1(c2ccccc2)NC(=O)NC1=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide?
The InChIKey is RUBXSGLQQASDOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c23-16(20-13-14-7-3-1-4-8-14)11-12-19(15-9-5-2-6-10-15)17(24)21-18(25)22-19/h1-10H,11-13H2,(H,20,23)(H2,21,22,24,25).
What are the key properties of N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide?
N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide has a molecular weight of 337.38 g/mol, XLogP of 1.82, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide is sourced from PubChem (CID 110677217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).