2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide

C13H15N3OS — CID 74077409

IUPAC2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide
SMILESCc1sc(NC(=O)C(C)N)nc1-c1ccccc1
InChIInChI=1S/C13H15N3OS/c1-8(14)12(17)16-13-15-11(9(2)18-13)10-6-4-3-5-7-10/h3-8H,14H2,1-2H3,(H,15,16,17)
InChIKeyYBJRXGCOAGWFHV-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.40
Rot. Bonds3

About 2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide

2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide (PubChem CID 74077409) has the molecular formula C13H15N3OS and a molecular weight of 261.35 g/mol. Its IUPAC name is 2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide
PubChem CID74077409
Molecular FormulaC13H15N3OS
Molecular Weight261.35 g/mol
Exact Mass261.09
IUPAC Name2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide
SMILESCc1sc(NC(=O)C(C)N)nc1-c1ccccc1
InChIInChI=1S/C13H15N3OS/c1-8(14)12(17)16-13-15-11(9(2)18-13)10-6-4-3-5-7-10/h3-8H,14H2,1-2H3,(H,15,16,17)
InChIKeyYBJRXGCOAGWFHV-UHFFFAOYSA-N
XLogP2.40
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)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

(2R)-2-amino-N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]propanamide
CID 119264683
(2S)-2-amino-3-methyl-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]butanamide;hydrochloride
CID 119267022
methyl N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)carbamate
CID 1220478
N,N'-bis(5-methyl-4-phenyl-1,3-thiazol-2-yl)butanediamide
CID 3493678
2-(4-chlorophenyl)-3-methyl-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)butanamide
CID 4868536
methyl 2-[2-[[(2S)-2-aminopropanoyl]amino]-4-phenyl-1,3-thiazol-5-yl]acetate;hydrochloride
CID 119304392
2-(4-tert-butylphenoxy)-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide
CID 19203493
2-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)carbamoyl]benzoate
CID 3649410
N-[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]-2-phenoxypropanamide
CID 4812491
(2R)-N-[4-(4-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-2-methylbutanamide
CID 25495361
2-methyl-3-(methylamino)-N-[5-methyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]propanamide;hydrochloride
CID 119681505
N-[4-(3-chlorophenyl)-5-methyl-1,3-thiazol-2-yl]-2-methylpropanamide
CID 19194860

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of 2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide (CID 74077409) is 2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide is Cc1sc(NC(=O)C(C)N)nc1-c1ccccc1.
What is the InChIKey of 2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide?
The InChIKey is YBJRXGCOAGWFHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3OS/c1-8(14)12(17)16-13-15-11(9(2)18-13)10-6-4-3-5-7-10/h3-8H,14H2,1-2H3,(H,15,16,17).
What are the key properties of 2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide?
2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide has a molecular weight of 261.35 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 74077409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).