N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide

C21H27NO4 — CID 31526543

IUPACN-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide
SMILESCCOc1ccc(OCC)c(NC(=O)CCOc2cc(C)ccc2C)c1
InChIInChI=1S/C21H27NO4/c1-5-24-17-9-10-19(25-6-2)18(14-17)22-21(23)11-12-26-20-13-15(3)7-8-16(20)4/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,22,23)
InChIKeyGKCDHNIUJCKZNV-UHFFFAOYSA-N
MW357.45 g/mol
LogP4.51
Rot. Bonds9

About N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide

N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide (PubChem CID 31526543) has the molecular formula C21H27NO4 and a molecular weight of 357.45 g/mol. Its IUPAC name is N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide.

Molecular Properties

Compound NameN-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide
PubChem CID31526543
Molecular FormulaC21H27NO4
Molecular Weight357.45 g/mol
Exact Mass357.19
IUPAC NameN-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide
SMILESCCOc1ccc(OCC)c(NC(=O)CCOc2cc(C)ccc2C)c1
InChIInChI=1S/C21H27NO4/c1-5-24-17-9-10-19(25-6-2)18(14-17)22-21(23)11-12-26-20-13-15(3)7-8-16(20)4/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,22,23)
InChIKeyGKCDHNIUJCKZNV-UHFFFAOYSA-N
XLogP4.51
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.45
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)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

N-(2,5-dimethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide
CID 2452955
3-(2,5-dimethylphenoxy)-N-(2,5-dimethylphenyl)propanamide
CID 26909495
N-(2-butoxy-5-methoxyphenyl)-2-(2,5-dimethylphenoxy)acetamide
CID 35366389
4-(2,5-diethoxyanilino)-4-oxobutanoic acid
CID 1133656
N-(2,5-diethoxyphenyl)-3-(4-methylphenyl)sulfonylpropanamide
CID 4101955
3-(2,5-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 26290770
N-(2,5-diethoxyphenyl)-5-hydroxypentanamide
CID 79198989
N-(2,5-diethoxyphenyl)-4-phenoxybutanamide
CID 31526572
N-(2,5-dimethylphenyl)-4-(4-ethoxyphenoxy)butanamide
CID 7991934
N-(2-ethoxyphenyl)-3-(3-methylphenoxy)propanamide
CID 2939056
N-(2-acetylphenyl)-3-(2,5-dimethylphenoxy)propanamide
CID 4803683
N-(2,5-diethoxyphenyl)-2-methoxyacetamide
CID 34737899

Frequently Asked Questions

What is the IUPAC name of N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide?
The IUPAC name of N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide (CID 31526543) is N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide.
What is the SMILES notation for N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide?
The canonical SMILES for N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide is CCOc1ccc(OCC)c(NC(=O)CCOc2cc(C)ccc2C)c1.
What is the InChIKey of N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide?
The InChIKey is GKCDHNIUJCKZNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO4/c1-5-24-17-9-10-19(25-6-2)18(14-17)22-21(23)11-12-26-20-13-15(3)7-8-16(20)4/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,22,23).
What are the key properties of N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide?
N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide has a molecular weight of 357.45 g/mol, XLogP of 4.51, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-diethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide is sourced from PubChem (CID 31526543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).