N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide

C14H15N3O2S — CID 110696392

IUPACN-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2nc(C)c(C)s2)cc1
InChIInChI=1S/C14H15N3O2S/c1-8-9(2)20-14(15-8)13(19)17-12-6-4-11(5-7-12)16-10(3)18/h4-7H,1-3H3,(H,16,18)(H,17,19)
InChIKeyILGDLHIWNREIMD-UHFFFAOYSA-N
MW289.36 g/mol
LogP2.97
Rot. Bonds3

About N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide

N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide (PubChem CID 110696392) has the molecular formula C14H15N3O2S and a molecular weight of 289.36 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide
PubChem CID110696392
Molecular FormulaC14H15N3O2S
Molecular Weight289.36 g/mol
Exact Mass289.09
IUPAC NameN-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2nc(C)c(C)s2)cc1
InChIInChI=1S/C14H15N3O2S/c1-8-9(2)20-14(15-8)13(19)17-12-6-4-11(5-7-12)16-10(3)18/h4-7H,1-3H3,(H,16,18)(H,17,19)
InChIKeyILGDLHIWNREIMD-UHFFFAOYSA-N
XLogP2.97
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.36
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide 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

N-(4-ethoxyphenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide
CID 110696380
N-(2,4-difluorophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide
CID 110696408
4,5-dimethyl-N-(trideuteriomethyl)-1,3-thiazole-2-carboxamide
CID 176866006
N-(4-acetamidophenyl)-5-(trifluoromethyl)-1,3,4-thiadiazole-2-carboxamide
CID 6422905
N-[4-[5-methyl-2-(methylamino)-1,3-thiazol-4-yl]phenyl]acetamide
CID 9356378
2-(4-acetamidophenyl)-N-tert-butyl-5-methyl-1,3-thiazole-4-carboxamide
CID 110342387
N-(4-methylphenyl)acetamide
CID 7684
N-(4-acetamidophenyl)-2-bromo-5-propan-2-yl-1,3-thiazole-4-carboxamide
CID 71703340
4,5-dimethyl-1,3-thiazole-2-carboxamide
CID 22382631
4-acetamido-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 27167057
N-(4,5-dimethyl-1,3-thiazol-2-yl)-4-(methylamino)benzamide
CID 55046054
N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide
CID 2223178

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide (CID 110696392) is N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide is CC(=O)Nc1ccc(NC(=O)c2nc(C)c(C)s2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide?
The InChIKey is ILGDLHIWNREIMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2S/c1-8-9(2)20-14(15-8)13(19)17-12-6-4-11(5-7-12)16-10(3)18/h4-7H,1-3H3,(H,16,18)(H,17,19).
What are the key properties of N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide?
N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide has a molecular weight of 289.36 g/mol, XLogP of 2.97, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 110696392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).