(2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide

C15H16ClN3O — CID 103797011

IUPAC(2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide
SMILESCc1cc(NC(=O)[C@H](N)Cc2ccccc2)cnc1Cl
InChIInChI=1S/C15H16ClN3O/c1-10-7-12(9-18-14(10)16)19-15(20)13(17)8-11-5-3-2-4-6-11/h2-7,9,13H,8,17H2,1H3,(H,19,20)/t13-/m1/s1
InChIKeyXFUMVNRNZUWBSK-CYBMUJFWSA-N
MW289.77 g/mol
LogP2.55
Rot. Bonds4

About (2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide

(2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide (PubChem CID 103797011) has the molecular formula C15H16ClN3O and a molecular weight of 289.77 g/mol. Its IUPAC name is (2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide
PubChem CID103797011
Molecular FormulaC15H16ClN3O
Molecular Weight289.77 g/mol
Exact Mass289.10
IUPAC Name(2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide
SMILESCc1cc(NC(=O)[C@H](N)Cc2ccccc2)cnc1Cl
InChIInChI=1S/C15H16ClN3O/c1-10-7-12(9-18-14(10)16)19-15(20)13(17)8-11-5-3-2-4-6-11/h2-7,9,13H,8,17H2,1H3,(H,19,20)/t13-/m1/s1
InChIKeyXFUMVNRNZUWBSK-CYBMUJFWSA-N
XLogP2.55
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze (2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-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

(2R)-2-amino-N-(4-fluoro-3-methylphenyl)-3-phenylpropanamide
CID 78917568
(2S)-2-amino-N-(4-bromo-3-methylphenyl)-3-phenylpropanamide
CID 22691303
(2S)-2-amino-N-(6-fluoro-3-pyridinyl)-3-phenylpropanamide
CID 103794914
(2S)-2-amino-N-(3-methylphenyl)-3-phenylpropanamide
CID 22691206
2-amino-N-(3-bromo-4-methylphenyl)-3-phenylpropanamide
CID 63334484
(2S)-2-amino-N-(3-bromo-4-methylphenyl)-3-phenylpropanamide
CID 22691230
(2R)-2-amino-N-(3-iodo-4-methylphenyl)-3-phenylpropanamide
CID 78985668
(2S)-N-(3-acetamidophenyl)-2-amino-3-phenylpropanamide
CID 22691247
2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-2-thiophen-2-ylacetamide
CID 114049418
2-amino-N-(3,5-dichloro-4-fluorophenyl)-3-phenylpropanamide
CID 107574453
2-amino-N-[3-chloro-5-(2-methyl-4-pyridinyl)phenyl]-3-phenylpropanamide
CID 77303408
(2S)-2-amino-N-(2-methylphenyl)-3-phenylpropanamide
CID 22691205

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide?
The IUPAC name of (2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide (CID 103797011) is (2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide?
The canonical SMILES for (2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide is Cc1cc(NC(=O)[C@H](N)Cc2ccccc2)cnc1Cl.
What is the InChIKey of (2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide?
The InChIKey is XFUMVNRNZUWBSK-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H16ClN3O/c1-10-7-12(9-18-14(10)16)19-15(20)13(17)8-11-5-3-2-4-6-11/h2-7,9,13H,8,17H2,1H3,(H,19,20)/t13-/m1/s1.
What are the key properties of (2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide?
(2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide has a molecular weight of 289.77 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(6-chloro-5-methyl-3-pyridinyl)-3-phenylpropanamide is sourced from PubChem (CID 103797011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).