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

C18H21NO3 — CID 26914656

IUPAC3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(NC(=O)CCOc2cc(C)ccc2C)c1
InChIInChI=1S/C18H21NO3/c1-13-7-8-14(2)17(11-13)22-10-9-18(20)19-15-5-4-6-16(12-15)21-3/h4-8,11-12H,9-10H2,1-3H3,(H,19,20)
InChIKeyZDHGGKGJSOMTJB-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.72
Rot. Bonds6

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

3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide (PubChem CID 26914656) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide.

Molecular Properties

Compound Name3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide
PubChem CID26914656
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(NC(=O)CCOc2cc(C)ccc2C)c1
InChIInChI=1S/C18H21NO3/c1-13-7-8-14(2)17(11-13)22-10-9-18(20)19-15-5-4-6-16(12-15)21-3/h4-8,11-12H,9-10H2,1-3H3,(H,19,20)
InChIKeyZDHGGKGJSOMTJB-UHFFFAOYSA-N
XLogP3.72
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-[3-(2,5-dimethylphenoxy)propanoylamino]benzoate
CID 26240710
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CID 16790811
3-(2,5-dimethylphenoxy)-N-(3-methylsulfonylphenyl)propanamide
CID 27334719
3-(2-chlorophenoxy)-N-(3-methoxyphenyl)propanamide
CID 39087786
4-(2-bromo-4-methylphenoxy)-N-(3-methoxyphenyl)butanamide
CID 19201641
N-(2,5-dimethoxyphenyl)-3-(2,5-dimethylphenoxy)propanamide
CID 2452955
2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 17123518
N-(3-methoxyphenyl)-3-(4-methylanilino)propanamide
CID 109034467
N-[3-(tert-butylsulfamoyl)phenyl]-3-(2,5-dimethylphenoxy)propanamide
CID 39736119
3-(2,5-dimethylphenoxy)-N-(2,5-dimethylphenyl)propanamide
CID 26909495
1-[2-(2-methoxy-4-methylphenoxy)ethyl]-3-(3-methoxyphenyl)urea
CID 112975367

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide?
The IUPAC name of 3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide (CID 26914656) is 3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide.
What is the SMILES notation for 3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide?
The canonical SMILES for 3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide is COc1cccc(NC(=O)CCOc2cc(C)ccc2C)c1.
What is the InChIKey of 3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide?
The InChIKey is ZDHGGKGJSOMTJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-13-7-8-14(2)17(11-13)22-10-9-18(20)19-15-5-4-6-16(12-15)21-3/h4-8,11-12H,9-10H2,1-3H3,(H,19,20).
What are the key properties of 3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide?
3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide has a molecular weight of 299.37 g/mol, XLogP of 3.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide is sourced from PubChem (CID 26914656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).