2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide

C15H19N3O3 — CID 65301981

IUPAC2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide
SMILESCC1(C)CC(=O)N(CC(N)(C(N)=O)c2ccccc2)C1=O
InChIInChI=1S/C15H19N3O3/c1-14(2)8-11(19)18(13(14)21)9-15(17,12(16)20)10-6-4-3-5-7-10/h3-7H,8-9,17H2,1-2H3,(H2,16,20)
InChIKeyRIIRRAYGXCCUJE-UHFFFAOYSA-N
MW289.33 g/mol
LogP0.11
Rot. Bonds4

About 2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide

2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide (PubChem CID 65301981) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide
PubChem CID65301981
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide
SMILESCC1(C)CC(=O)N(CC(N)(C(N)=O)c2ccccc2)C1=O
InChIInChI=1S/C15H19N3O3/c1-14(2)8-11(19)18(13(14)21)9-15(17,12(16)20)10-6-4-3-5-7-10/h3-7H,8-9,17H2,1-2H3,(H2,16,20)
InChIKeyRIIRRAYGXCCUJE-UHFFFAOYSA-N
XLogP0.11
TPSA106.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide 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 2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide?
The IUPAC name of 2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide (CID 65301981) is 2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide.
What is the SMILES notation for 2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide?
The canonical SMILES for 2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide is CC1(C)CC(=O)N(CC(N)(C(N)=O)c2ccccc2)C1=O.
What is the InChIKey of 2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide?
The InChIKey is RIIRRAYGXCCUJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-14(2)8-11(19)18(13(14)21)9-15(17,12(16)20)10-6-4-3-5-7-10/h3-7H,8-9,17H2,1-2H3,(H2,16,20).
What are the key properties of 2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide?
2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide has a molecular weight of 289.33 g/mol, XLogP of 0.11, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(3,3-dimethyl-2,5-dioxopyrrolidin-1-yl)-2-phenylpropanamide is sourced from PubChem (CID 65301981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).