3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide

C20H21N3O3 — CID 110677220

IUPAC3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide
SMILESCc1ccc(CNC(=O)CCC2(c3ccccc3)NC(=O)NC2=O)cc1
InChIInChI=1S/C20H21N3O3/c1-14-7-9-15(10-8-14)13-21-17(24)11-12-20(16-5-3-2-4-6-16)18(25)22-19(26)23-20/h2-10H,11-13H2,1H3,(H,21,24)(H2,22,23,25,26)
InChIKeyBCNDJVYTVIBETH-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.13
Rot. Bonds6

About 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide

3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide (PubChem CID 110677220) 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-[(4-methylphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide
PubChem CID110677220
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC Name3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide
SMILESCc1ccc(CNC(=O)CCC2(c3ccccc3)NC(=O)NC2=O)cc1
InChIInChI=1S/C20H21N3O3/c1-14-7-9-15(10-8-14)13-21-17(24)11-12-20(16-5-3-2-4-6-16)18(25)22-19(26)23-20/h2-10H,11-13H2,1H3,(H,21,24)(H2,22,23,25,26)
InChIKeyBCNDJVYTVIBETH-UHFFFAOYSA-N
XLogP2.13
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide with MolForge

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

Launch Full Analysis

Related Compounds

N-benzyl-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide
CID 110677217
N-[(2-chlorophenyl)methyl]-3-(2,5-dioxo-4-phenylimidazolidin-4-yl)propanamide
CID 110677225
3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-(pyridin-2-ylmethyl)propanamide
CID 110677230
3-anilino-N-[(4-methylphenyl)methyl]propanamide
CID 109019803
N-[(4-methylphenyl)methyl]-3-[3-(trifluoromethyl)diaziridin-3-yl]propanamide
CID 118133029
5-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-5-phenylimidazolidine-2,4-dione
CID 110677215
3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-(4-methoxyphenyl)propanamide
CID 110677281
N-benzyl-3-[(4-methylphenyl)methylamino]propanamide
CID 109018747
N-[(4-methylphenyl)methyl]butanamide
CID 835678
N-benzyl-2-[(4R)-4-ethyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 26010815
N-benzyl-3-(4-methylanilino)propanamide
CID 109018805
(5S)-5-ethyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 7128778

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide?
The IUPAC name of 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide (CID 110677220) is 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide.
What is the SMILES notation for 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide?
The canonical SMILES for 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide is Cc1ccc(CNC(=O)CCC2(c3ccccc3)NC(=O)NC2=O)cc1.
What is the InChIKey of 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide?
The InChIKey is BCNDJVYTVIBETH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-14-7-9-15(10-8-14)13-21-17(24)11-12-20(16-5-3-2-4-6-16)18(25)22-19(26)23-20/h2-10H,11-13H2,1H3,(H,21,24)(H2,22,23,25,26).
What are the key properties of 3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide?
3-(2,5-dioxo-4-phenylimidazolidin-4-yl)-N-[(4-methylphenyl)methyl]propanamide has a molecular weight of 351.41 g/mol, XLogP of 2.13, 6 rotatable bonds, 3 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-[(4-methylphenyl)methyl]propanamide is sourced from PubChem (CID 110677220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).