N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide

C21H21NO3 — CID 7652726

IUPACN-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide
SMILESCOc1ccc2ccc(OCC(=O)Nc3cc(C)cc(C)c3)cc2c1
InChIInChI=1S/C21H21NO3/c1-14-8-15(2)10-18(9-14)22-21(23)13-25-20-7-5-16-4-6-19(24-3)11-17(16)12-20/h4-12H,13H2,1-3H3,(H,22,23)
InChIKeyZKCGUTQJUQLGFF-UHFFFAOYSA-N
MW335.40 g/mol
LogP4.48
Rot. Bonds5

About N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide

N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide (PubChem CID 7652726) has the molecular formula C21H21NO3 and a molecular weight of 335.40 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide
PubChem CID7652726
Molecular FormulaC21H21NO3
Molecular Weight335.40 g/mol
Exact Mass335.15
IUPAC NameN-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide
SMILESCOc1ccc2ccc(OCC(=O)Nc3cc(C)cc(C)c3)cc2c1
InChIInChI=1S/C21H21NO3/c1-14-8-15(2)10-18(9-14)22-21(23)13-25-20-7-5-16-4-6-19(24-3)11-17(16)12-20/h4-12H,13H2,1-3H3,(H,22,23)
InChIKeyZKCGUTQJUQLGFF-UHFFFAOYSA-N
XLogP4.48
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.40
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide (CID 7652726) is N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide is COc1ccc2ccc(OCC(=O)Nc3cc(C)cc(C)c3)cc2c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide?
The InChIKey is ZKCGUTQJUQLGFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO3/c1-14-8-15(2)10-18(9-14)22-21(23)13-25-20-7-5-16-4-6-19(24-3)11-17(16)12-20/h4-12H,13H2,1-3H3,(H,22,23).
What are the key properties of N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide?
N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide has a molecular weight of 335.40 g/mol, XLogP of 4.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide is sourced from PubChem (CID 7652726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).