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

C17H19NO2 — CID 679596

IUPAC2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)COc2ccc(C)c(C)c2)c1
InChIInChI=1S/C17H19NO2/c1-12-5-4-6-15(9-12)18-17(19)11-20-16-8-7-13(2)14(3)10-16/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyQHSCYPXRVBMROS-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.63
Rot. Bonds4

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

2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide (PubChem CID 679596) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide
PubChem CID679596
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)COc2ccc(C)c(C)c2)c1
InChIInChI=1S/C17H19NO2/c1-12-5-4-6-15(9-12)18-17(19)11-20-16-8-7-13(2)14(3)10-16/h4-10H,11H2,1-3H3,(H,18,19)
InChIKeyQHSCYPXRVBMROS-UHFFFAOYSA-N
XLogP3.63
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide (CID 679596) is 2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide is Cc1cccc(NC(=O)COc2ccc(C)c(C)c2)c1.
What is the InChIKey of 2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide?
The InChIKey is QHSCYPXRVBMROS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-12-5-4-6-15(9-12)18-17(19)11-20-16-8-7-13(2)14(3)10-16/h4-10H,11H2,1-3H3,(H,18,19).
What are the key properties of 2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide?
2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide has a molecular weight of 269.34 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 679596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).