2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide

C17H19NO3 — CID 875960

IUPAC2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2ccc(C)cc2C)c1
InChIInChI=1S/C17H19NO3/c1-12-7-8-16(13(2)9-12)21-11-17(19)18-14-5-4-6-15(10-14)20-3/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyTVABVJJFKWGGGP-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.33
Rot. Bonds5

About 2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide

2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide (PubChem CID 875960) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide
PubChem CID875960
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)COc2ccc(C)cc2C)c1
InChIInChI=1S/C17H19NO3/c1-12-7-8-16(13(2)9-12)21-11-17(19)18-14-5-4-6-15(10-14)20-3/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyTVABVJJFKWGGGP-UHFFFAOYSA-N
XLogP3.33
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide (CID 875960) is 2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)COc2ccc(C)cc2C)c1.
What is the InChIKey of 2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide?
The InChIKey is TVABVJJFKWGGGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-12-7-8-16(13(2)9-12)21-11-17(19)18-14-5-4-6-15(10-14)20-3/h4-10H,11H2,1-3H3,(H,18,19).
What are the key properties of 2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide?
2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide has a molecular weight of 285.34 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenoxy)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 875960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).