2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide

C12H11ClN2OS — CID 3979206

IUPAC2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide
SMILESCc1cnc(NC(=O)C(Cl)c2ccccc2)s1
InChIInChI=1S/C12H11ClN2OS/c1-8-7-14-12(17-8)15-11(16)10(13)9-5-3-2-4-6-9/h2-7,10H,1H3,(H,14,15,16)
InChIKeyDZKUZDXBALPZMX-UHFFFAOYSA-N
MW266.75 g/mol
LogP3.37
Rot. Bonds3

About 2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide

2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide (PubChem CID 3979206) has the molecular formula C12H11ClN2OS and a molecular weight of 266.75 g/mol. Its IUPAC name is 2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide.

Molecular Properties

Compound Name2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide
PubChem CID3979206
Molecular FormulaC12H11ClN2OS
Molecular Weight266.75 g/mol
Exact Mass266.03
IUPAC Name2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide
SMILESCc1cnc(NC(=O)C(Cl)c2ccccc2)s1
InChIInChI=1S/C12H11ClN2OS/c1-8-7-14-12(17-8)15-11(16)10(13)9-5-3-2-4-6-9/h2-7,10H,1H3,(H,14,15,16)
InChIKeyDZKUZDXBALPZMX-UHFFFAOYSA-N
XLogP3.37
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 ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide 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

2-chloro-N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide
CID 4969220
N-(5-methyl-1,3-thiazol-2-yl)-2-phenoxypropanamide
CID 4812532
(3R)-3-acetamido-N-(5-methyl-1,3-thiazol-2-yl)-3-phenylpropanamide
CID 9451642
N-(5-methyl-1,3-thiazol-2-yl)-2-(4-phenylphenoxy)propanamide
CID 46481508
2-chloro-2-phenyl-N-(thiatriazol-5-yl)acetamide
CID 114912026
2-chloro-N-[(5-methyl-1,3-thiazol-2-yl)carbamoyl]propanamide
CID 43146246
2-(2-hydroxyphenyl)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 78990794
3-amino-4-[(5-methyl-1,3-thiazol-2-yl)amino]-4-oxobutanoic acid
CID 64894875
(2R)-N-(5-methyl-1,3-thiazol-2-yl)-2-[(2-phenoxyacetyl)amino]propanamide
CID 94801580
2-(2-methoxyphenoxy)-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 17190948
(2R)-2-methylsulfonyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 94024935
N-(5-methyl-1,3-thiazol-2-yl)-2-(2-propan-2-ylphenoxy)propanamide
CID 17190939

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide?
The IUPAC name of 2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide (CID 3979206) is 2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide.
What is the SMILES notation for 2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide?
The canonical SMILES for 2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide is Cc1cnc(NC(=O)C(Cl)c2ccccc2)s1.
What is the InChIKey of 2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide?
The InChIKey is DZKUZDXBALPZMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2OS/c1-8-7-14-12(17-8)15-11(16)10(13)9-5-3-2-4-6-9/h2-7,10H,1H3,(H,14,15,16).
What are the key properties of 2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide?
2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide has a molecular weight of 266.75 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-2-phenylacetamide is sourced from PubChem (CID 3979206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).