N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide

C15H17N3O3S — CID 87005139

IUPACN-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide
SMILESCCNC(=O)c1ccc(NC(=O)Cn2c(C)csc2=O)cc1
InChIInChI=1S/C15H17N3O3S/c1-3-16-14(20)11-4-6-12(7-5-11)17-13(19)8-18-10(2)9-22-15(18)21/h4-7,9H,3,8H2,1-2H3,(H,16,20)(H,17,19)
InChIKeyXVWLVQCYEFSRTJ-UHFFFAOYSA-N
MW319.39 g/mol
LogP1.61
Rot. Bonds5

About N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide

N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide (PubChem CID 87005139) has the molecular formula C15H17N3O3S and a molecular weight of 319.39 g/mol. Its IUPAC name is N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide
PubChem CID87005139
Molecular FormulaC15H17N3O3S
Molecular Weight319.39 g/mol
Exact Mass319.10
IUPAC NameN-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide
SMILESCCNC(=O)c1ccc(NC(=O)Cn2c(C)csc2=O)cc1
InChIInChI=1S/C15H17N3O3S/c1-3-16-14(20)11-4-6-12(7-5-11)17-13(19)8-18-10(2)9-22-15(18)21/h4-7,9H,3,8H2,1-2H3,(H,16,20)(H,17,19)
InChIKeyXVWLVQCYEFSRTJ-UHFFFAOYSA-N
XLogP1.61
TPSA80.20 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.39
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide 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

4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide
CID 9192131
methyl 2-[[4-[3-(4-methyl-2-oxo-1,3-thiazol-3-yl)propanoylamino]benzoyl]amino]acetate
CID 46538899
N-ethyl-4-[[2-[4-(ethylcarbamoyl)anilino]-2-oxoethyl]amino]benzamide
CID 54839505
N-ethyl-4-[[2-(propylamino)acetyl]amino]benzamide
CID 54818586
4-[[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]methyl]benzoic acid
CID 43171939
3-[4-(ethylcarbamoyl)anilino]-3-oxopropanoic acid
CID 55049118
2-[2-[4-(ethylcarbamoyl)anilino]-2-oxoethyl]sulfanylacetic acid
CID 104569378
[4-(ethylcarbamoyl)phenyl]carbamic acid;propane
CID 142227182
4-methyl-3-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzoic acid
CID 43132376
3-[2-(4-ethylphenyl)-2-oxoethyl]-4-methyl-1,3-thiazol-2-one
CID 62025239
4-[(3-amino-3-methylbutanoyl)amino]-N-ethylbenzamide
CID 64684848
N-(2-hydroxy-2-methylpropyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 65109590

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide?
The IUPAC name of N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide (CID 87005139) is N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide.
What is the SMILES notation for N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide?
The canonical SMILES for N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide is CCNC(=O)c1ccc(NC(=O)Cn2c(C)csc2=O)cc1.
What is the InChIKey of N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide?
The InChIKey is XVWLVQCYEFSRTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3S/c1-3-16-14(20)11-4-6-12(7-5-11)17-13(19)8-18-10(2)9-22-15(18)21/h4-7,9H,3,8H2,1-2H3,(H,16,20)(H,17,19).
What are the key properties of N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide?
N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide has a molecular weight of 319.39 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetyl]amino]benzamide is sourced from PubChem (CID 87005139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).