4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide

C16H20N2O3S — CID 2679260

IUPAC4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide
SMILESCCOc1ccccc1OCCCC(=O)Nc1nc(C)cs1
InChIInChI=1S/C16H20N2O3S/c1-3-20-13-7-4-5-8-14(13)21-10-6-9-15(19)18-16-17-12(2)11-22-16/h4-5,7-8,11H,3,6,9-10H2,1-2H3,(H,17,18,19)
InChIKeyYRRNDAACZZNMKG-UHFFFAOYSA-N
MW320.41 g/mol
LogP3.65
Rot. Bonds8

About 4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide

4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide (PubChem CID 2679260) has the molecular formula C16H20N2O3S and a molecular weight of 320.41 g/mol. Its IUPAC name is 4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide.

Molecular Properties

Compound Name4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide
PubChem CID2679260
Molecular FormulaC16H20N2O3S
Molecular Weight320.41 g/mol
Exact Mass320.12
IUPAC Name4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide
SMILESCCOc1ccccc1OCCCC(=O)Nc1nc(C)cs1
InChIInChI=1S/C16H20N2O3S/c1-3-20-13-7-4-5-8-14(13)21-10-6-9-15(19)18-16-17-12(2)11-22-16/h4-5,7-8,11H,3,6,9-10H2,1-2H3,(H,17,18,19)
InChIKeyYRRNDAACZZNMKG-UHFFFAOYSA-N
XLogP3.65
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide 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

3-(2-methoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 2522764
N-(4-methyl-1,3-thiazol-2-yl)-3-phenoxypropanamide
CID 17361679
4-(2-ethoxyphenoxy)-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]butanamide
CID 2525275
4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide
CID 7935064
N-(4-methyl-1,3-thiazol-2-yl)tetradecanamide
CID 139176889
4-(2-aminophenoxy)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]butanamide
CID 84560731
2-(2-bromophenoxy)-N-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 17361677
N-(4-methyl-1,3-thiazol-2-yl)-2-(2-propan-2-ylphenoxy)acetamide
CID 7770883
5-hydroxy-N-(4-methyl-1,3-thiazol-2-yl)pentanamide
CID 79198899
(2R)-2-(2-ethoxyanilino)-N-(4-methyl-1,3-thiazol-2-yl)propanamide
CID 8558782
4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylbutanamide
CID 112765245
N-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-4-phenoxybutanamide
CID 19173206

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide?
The IUPAC name of 4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide (CID 2679260) is 4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide.
What is the SMILES notation for 4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide?
The canonical SMILES for 4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide is CCOc1ccccc1OCCCC(=O)Nc1nc(C)cs1.
What is the InChIKey of 4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide?
The InChIKey is YRRNDAACZZNMKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3S/c1-3-20-13-7-4-5-8-14(13)21-10-6-9-15(19)18-16-17-12(2)11-22-16/h4-5,7-8,11H,3,6,9-10H2,1-2H3,(H,17,18,19).
What are the key properties of 4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide?
4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide has a molecular weight of 320.41 g/mol, XLogP of 3.65, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyphenoxy)-N-(4-methyl-1,3-thiazol-2-yl)butanamide is sourced from PubChem (CID 2679260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).