(2S)-2-hydroxy-N-(3-iodophenyl)propanamide

C9H10INO2 — CID 130653575

IUPAC(2S)-2-hydroxy-N-(3-iodophenyl)propanamide
SMILESC[C@H](O)C(=O)Nc1cccc(I)c1
InChIInChI=1S/C9H10INO2/c1-6(12)9(13)11-8-4-2-3-7(10)5-8/h2-6,12H,1H3,(H,11,13)/t6-/m0/s1
InChIKeyJWHBUDYALITMPU-LURJTMIESA-N
MW291.09 g/mol
LogP1.61
Rot. Bonds2

About (2S)-2-hydroxy-N-(3-iodophenyl)propanamide

(2S)-2-hydroxy-N-(3-iodophenyl)propanamide (PubChem CID 130653575) has the molecular formula C9H10INO2 and a molecular weight of 291.09 g/mol. Its IUPAC name is (2S)-2-hydroxy-N-(3-iodophenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-hydroxy-N-(3-iodophenyl)propanamide
PubChem CID130653575
Molecular FormulaC9H10INO2
Molecular Weight291.09 g/mol
Exact Mass290.98
IUPAC Name(2S)-2-hydroxy-N-(3-iodophenyl)propanamide
SMILESC[C@H](O)C(=O)Nc1cccc(I)c1
InChIInChI=1S/C9H10INO2/c1-6(12)9(13)11-8-4-2-3-7(10)5-8/h2-6,12H,1H3,(H,11,13)/t6-/m0/s1
InChIKeyJWHBUDYALITMPU-LURJTMIESA-N
XLogP1.61
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.09
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2S)-2-hydroxy-N-(3-iodophenyl)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

(2S)-2-amino-N-(3-iodophenyl)propanamide
CID 28882940
3-(3-iodoanilino)-2-methyl-3-oxopropanoic acid
CID 114897091
(2R)-2-hydroxy-N-(3-hydroxyphenyl)propanamide
CID 130735484
2-cyclopropyl-N-(3-iodophenyl)propanamide
CID 79507143
N-(3-bromophenyl)-2-hydroxypropanamide
CID 82130318
2-hydroxy-N-(3-methoxyphenyl)propanamide
CID 82125804
(2S)-2-(3-chlorophenoxy)-N-(3-iodophenyl)propanamide
CID 1313423
(2S)-2-hydroxy-N-pyridin-4-ylpropanamide
CID 130695584
3-[2-(3-iodoanilino)propanoylamino]-N-methylbenzamide
CID 112811069
N-(3-iodophenyl)-2-(1,2,4-triazol-1-yl)propanamide
CID 60729037
(2S)-2-(4-acetylphenoxy)-N-(3-iodophenyl)propanamide
CID 26517522
N-(3-iodophenyl)-3-methylpentanamide
CID 114874887

Frequently Asked Questions

What is the IUPAC name of (2S)-2-hydroxy-N-(3-iodophenyl)propanamide?
The IUPAC name of (2S)-2-hydroxy-N-(3-iodophenyl)propanamide (CID 130653575) is (2S)-2-hydroxy-N-(3-iodophenyl)propanamide.
What is the SMILES notation for (2S)-2-hydroxy-N-(3-iodophenyl)propanamide?
The canonical SMILES for (2S)-2-hydroxy-N-(3-iodophenyl)propanamide is C[C@H](O)C(=O)Nc1cccc(I)c1.
What is the InChIKey of (2S)-2-hydroxy-N-(3-iodophenyl)propanamide?
The InChIKey is JWHBUDYALITMPU-LURJTMIESA-N. The full InChI is InChI=1S/C9H10INO2/c1-6(12)9(13)11-8-4-2-3-7(10)5-8/h2-6,12H,1H3,(H,11,13)/t6-/m0/s1.
What are the key properties of (2S)-2-hydroxy-N-(3-iodophenyl)propanamide?
(2S)-2-hydroxy-N-(3-iodophenyl)propanamide has a molecular weight of 291.09 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-hydroxy-N-(3-iodophenyl)propanamide is sourced from PubChem (CID 130653575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).