N-(2,6-dimethylphenyl)-2-phenoxyacetamide

C16H17NO2 — CID 762949

IUPACN-(2,6-dimethylphenyl)-2-phenoxyacetamide
SMILESCc1cccc(C)c1NC(=O)COc1ccccc1
InChIInChI=1S/C16H17NO2/c1-12-7-6-8-13(2)16(12)17-15(18)11-19-14-9-4-3-5-10-14/h3-10H,11H2,1-2H3,(H,17,18)
InChIKeyTUTXAZQNHSFZCR-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.32
Rot. Bonds4

About N-(2,6-dimethylphenyl)-2-phenoxyacetamide

N-(2,6-dimethylphenyl)-2-phenoxyacetamide (PubChem CID 762949) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-phenoxyacetamide
PubChem CID762949
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC NameN-(2,6-dimethylphenyl)-2-phenoxyacetamide
SMILESCc1cccc(C)c1NC(=O)COc1ccccc1
InChIInChI=1S/C16H17NO2/c1-12-7-6-8-13(2)16(12)17-15(18)11-19-14-9-4-3-5-10-14/h3-10H,11H2,1-2H3,(H,17,18)
InChIKeyTUTXAZQNHSFZCR-UHFFFAOYSA-N
XLogP3.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-phenoxyacetamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-phenoxyacetamide (CID 762949) is N-(2,6-dimethylphenyl)-2-phenoxyacetamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-phenoxyacetamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-phenoxyacetamide is Cc1cccc(C)c1NC(=O)COc1ccccc1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-phenoxyacetamide?
The InChIKey is TUTXAZQNHSFZCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-12-7-6-8-13(2)16(12)17-15(18)11-19-14-9-4-3-5-10-14/h3-10H,11H2,1-2H3,(H,17,18).
What are the key properties of N-(2,6-dimethylphenyl)-2-phenoxyacetamide?
N-(2,6-dimethylphenyl)-2-phenoxyacetamide has a molecular weight of 255.32 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-phenoxyacetamide is sourced from PubChem (CID 762949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).