(2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide

C12H11ClN2OS — CID 46226333

IUPAC(2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide
SMILESC[C@H](C(=O)Nc1nccs1)c1ccc(Cl)cc1
InChIInChI=1S/C12H11ClN2OS/c1-8(9-2-4-10(13)5-3-9)11(16)15-12-14-6-7-17-12/h2-8H,1H3,(H,14,15,16)/t8-/m0/s1
InChIKeyBUUYHTPGJCUOIM-QMMMGPOBSA-N
MW266.75 g/mol
LogP3.54
Rot. Bonds3

About (2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide

(2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide (PubChem CID 46226333) has the molecular formula C12H11ClN2OS and a molecular weight of 266.75 g/mol. Its IUPAC name is (2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide
PubChem CID46226333
Molecular FormulaC12H11ClN2OS
Molecular Weight266.75 g/mol
Exact Mass266.03
IUPAC Name(2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide
SMILESC[C@H](C(=O)Nc1nccs1)c1ccc(Cl)cc1
InChIInChI=1S/C12H11ClN2OS/c1-8(9-2-4-10(13)5-3-9)11(16)15-12-14-6-7-17-12/h2-8H,1H3,(H,14,15,16)/t8-/m0/s1
InChIKeyBUUYHTPGJCUOIM-QMMMGPOBSA-N
XLogP3.54
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.75
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S)-2-(4-chlorophenyl)-N-(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

(2S)-2-phenyl-N-(1,3-thiazol-2-yl)propanamide
CID 97038201
1-[(1S)-1-(4-chlorophenyl)ethyl]-3-(1,3-thiazol-2-yl)urea
CID 51932156
(2R)-2-(6-chloro-9H-carbazol-2-yl)-N-(1,3-thiazol-2-yl)propanamide
CID 41062772
2-(4-chlorophenyl)-2-(4-methylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 10309071
(2R)-2-(3-fluoro-4-phenylphenyl)-N-(1,3-thiazol-2-yl)propanamide
CID 40961510
(2S)-2-[4-[[(1R)-2-oxocyclopentyl]methyl]phenyl]-N-(1,3-thiazol-2-yl)propanamide
CID 97266360
(2S)-2-(methylamino)-N-(1,3-thiazol-2-yl)propanamide
CID 59361268
2-(2-bromo-4-chlorophenoxy)-N-(1,3-thiazol-2-yl)propanamide
CID 4981351
(2S)-2-methyl-N-(1,3-thiazol-2-yl)pentanamide
CID 7302765
2-[(4-chlorophenyl)sulfonylamino]-3-hydroxy-N-(1,3-thiazol-2-yl)propanamide
CID 3265126
(2S)-2-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-N-(1,3-thiazol-2-yl)propanamide
CID 100842922
(2S)-2-(4-chlorophenyl)-N-methylpropanamide
CID 143748208

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of (2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide (CID 46226333) is (2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for (2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for (2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide is C[C@H](C(=O)Nc1nccs1)c1ccc(Cl)cc1.
What is the InChIKey of (2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide?
The InChIKey is BUUYHTPGJCUOIM-QMMMGPOBSA-N. The full InChI is InChI=1S/C12H11ClN2OS/c1-8(9-2-4-10(13)5-3-9)11(16)15-12-14-6-7-17-12/h2-8H,1H3,(H,14,15,16)/t8-/m0/s1.
What are the key properties of (2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide?
(2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide has a molecular weight of 266.75 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 46226333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).