2-amino-N-(3-iodophenyl)-3-phenylpropanamide

C15H15IN2O — CID 43124635

IUPAC2-amino-N-(3-iodophenyl)-3-phenylpropanamide
SMILESNC(Cc1ccccc1)C(=O)Nc1cccc(I)c1
InChIInChI=1S/C15H15IN2O/c16-12-7-4-8-13(10-12)18-15(19)14(17)9-11-5-2-1-3-6-11/h1-8,10,14H,9,17H2,(H,18,19)
InChIKeyXHHYZVJYKDJOPU-UHFFFAOYSA-N
MW366.20 g/mol
LogP2.80
Rot. Bonds4

About 2-amino-N-(3-iodophenyl)-3-phenylpropanamide

2-amino-N-(3-iodophenyl)-3-phenylpropanamide (PubChem CID 43124635) has the molecular formula C15H15IN2O and a molecular weight of 366.20 g/mol. Its IUPAC name is 2-amino-N-(3-iodophenyl)-3-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-(3-iodophenyl)-3-phenylpropanamide
PubChem CID43124635
Molecular FormulaC15H15IN2O
Molecular Weight366.20 g/mol
Exact Mass366.02
IUPAC Name2-amino-N-(3-iodophenyl)-3-phenylpropanamide
SMILESNC(Cc1ccccc1)C(=O)Nc1cccc(I)c1
InChIInChI=1S/C15H15IN2O/c16-12-7-4-8-13(10-12)18-15(19)14(17)9-11-5-2-1-3-6-11/h1-8,10,14H,9,17H2,(H,18,19)
InChIKeyXHHYZVJYKDJOPU-UHFFFAOYSA-N
XLogP2.80
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.20
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-amino-N-(3-iodophenyl)-3-phenylpropanamide 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

(2S)-N-(3-acetamidophenyl)-2-amino-3-phenylpropanamide
CID 22691247
(2R)-2-amino-N-(4-iodophenyl)-3-phenylpropanamide
CID 28976654
(2S)-2-amino-N-(3-methylphenyl)-3-phenylpropanamide
CID 22691206
(2S)-2-amino-N-(3-fluorophenyl)-3-phenylpropanamide
CID 22691298
(2R)-2-amino-N-(3-iodo-4-methylphenyl)-3-phenylpropanamide
CID 78985668
2-amino-N-naphthalen-2-yl-3-phenylpropanamide
CID 577793
2-amino-N-(3-ethoxyphenyl)-3-phenylpropanamide
CID 60927036
2-amino-N-(4-iodo-2-methylphenyl)-3-phenylpropanamide
CID 43708097
(2R)-2-amino-N-(4-fluoro-3-methylphenyl)-3-phenylpropanamide
CID 78917568
2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide
CID 24703610
(2S)-2-amino-N-[3-(1-methoxyethyl)phenyl]-3-phenylpropanamide
CID 119314874
(2S)-N-[3-(acetylsulfamoyl)phenyl]-2-amino-3-phenylpropanamide
CID 57200354

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-iodophenyl)-3-phenylpropanamide?
The IUPAC name of 2-amino-N-(3-iodophenyl)-3-phenylpropanamide (CID 43124635) is 2-amino-N-(3-iodophenyl)-3-phenylpropanamide.
What is the SMILES notation for 2-amino-N-(3-iodophenyl)-3-phenylpropanamide?
The canonical SMILES for 2-amino-N-(3-iodophenyl)-3-phenylpropanamide is NC(Cc1ccccc1)C(=O)Nc1cccc(I)c1.
What is the InChIKey of 2-amino-N-(3-iodophenyl)-3-phenylpropanamide?
The InChIKey is XHHYZVJYKDJOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15IN2O/c16-12-7-4-8-13(10-12)18-15(19)14(17)9-11-5-2-1-3-6-11/h1-8,10,14H,9,17H2,(H,18,19).
What are the key properties of 2-amino-N-(3-iodophenyl)-3-phenylpropanamide?
2-amino-N-(3-iodophenyl)-3-phenylpropanamide has a molecular weight of 366.20 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-iodophenyl)-3-phenylpropanamide is sourced from PubChem (CID 43124635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).