2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide

C16H17ClN2O2 — CID 9414673

IUPAC2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide
SMILESCc1cc(Cl)cc(C)c1OCC(=O)NCc1ccccn1
InChIInChI=1S/C16H17ClN2O2/c1-11-7-13(17)8-12(2)16(11)21-10-15(20)19-9-14-5-3-4-6-18-14/h3-8H,9-10H2,1-2H3,(H,19,20)
InChIKeyGWRWFKYFDZTEKY-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.05
Rot. Bonds5

About 2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide

2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 9414673) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is 2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide
PubChem CID9414673
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC Name2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide
SMILESCc1cc(Cl)cc(C)c1OCC(=O)NCc1ccccn1
InChIInChI=1S/C16H17ClN2O2/c1-11-7-13(17)8-12(2)16(11)21-10-15(20)19-9-14-5-3-4-6-18-14/h3-8H,9-10H2,1-2H3,(H,19,20)
InChIKeyGWRWFKYFDZTEKY-UHFFFAOYSA-N
XLogP3.05
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chloro-2-methylphenyl)-N-(pyridin-2-ylmethyl)acetamide
CID 67968189
N-(pyridin-2-ylmethyl)-2-(2,4,6-tribromophenoxy)acetamide
CID 17359500
2-phenoxy-N-(pyridin-2-ylmethyl)acetamide
CID 853197
2-(2,6-dimethylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide
CID 29292137
2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-2-ylacetamide
CID 2892737
2-(3-acetylphenoxy)-N-(pyridin-2-ylmethyl)acetamide
CID 40628702
2-(2,6-dimethylphenoxy)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]acetamide
CID 46478039
2-(4-propoxyphenoxy)-N-(pyridin-2-ylmethyl)acetamide
CID 35750358
1-(pyridin-2-ylmethyl)-3-[2-(2,4,6-trimethylphenoxy)ethyl]urea
CID 112974576
N-(pyridin-2-ylmethyl)-2-(2,4,6-trimethylphenyl)acetamide
CID 110767858
2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide
CID 100819848
2-(4-chloro-2,6-dimethylphenoxy)-N-phenylmethoxyacetamide
CID 9227392

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide (CID 9414673) is 2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide is Cc1cc(Cl)cc(C)c1OCC(=O)NCc1ccccn1.
What is the InChIKey of 2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is GWRWFKYFDZTEKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-11-7-13(17)8-12(2)16(11)21-10-15(20)19-9-14-5-3-4-6-18-14/h3-8H,9-10H2,1-2H3,(H,19,20).
What are the key properties of 2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide?
2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 304.78 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 9414673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).