2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide

C15H23NO2 — CID 78906214

IUPAC2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide
SMILESCc1ccc(C(C)C)cc1OCC(=O)NC(C)C
InChIInChI=1S/C15H23NO2/c1-10(2)13-7-6-12(5)14(8-13)18-9-15(17)16-11(3)4/h6-8,10-11H,9H2,1-5H3,(H,16,17)
InChIKeyAKPQSOFNROQFIK-UHFFFAOYSA-N
MW249.35 g/mol
LogP3.02
Rot. Bonds5

About 2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide

2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide (PubChem CID 78906214) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide
PubChem CID78906214
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide
SMILESCc1ccc(C(C)C)cc1OCC(=O)NC(C)C
InChIInChI=1S/C15H23NO2/c1-10(2)13-7-6-12(5)14(8-13)18-9-15(17)16-11(3)4/h6-8,10-11H,9H2,1-5H3,(H,16,17)
InChIKeyAKPQSOFNROQFIK-UHFFFAOYSA-N
XLogP3.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-amino-2-methylphenoxy)-N-propan-2-ylacetamide
CID 43520249
2-(2-bromo-4-propan-2-ylphenoxy)-N-propan-2-ylacetamide
CID 19202796
2-(2-fluoro-4-propan-2-ylphenoxy)-N-propan-2-ylacetamide
CID 167446728
N-(2-cyanoethyl)-2-(2-methyl-5-propan-2-ylphenoxy)acetamide
CID 78909836
3,3-dimethyl-1-(2-methyl-5-propan-2-ylphenoxy)butan-2-one
CID 60623601
N-[2-(4-chlorophenyl)ethyl]-2-(2-methyl-5-propan-2-ylphenoxy)acetamide
CID 18293065
N-(2,5-dimethoxyphenyl)-2-(2-methyl-5-propan-2-ylphenoxy)acetamide
CID 7962700
N-[2-(cyclohexen-1-yl)ethyl]-2-(2-methyl-5-propan-2-ylphenoxy)acetamide
CID 177377392
N-[4-(cyanomethyl)phenyl]-2-(2-methyl-5-propan-2-ylphenoxy)acetamide
CID 9260247
N-[(3,4-dimethoxyphenyl)methyl]-2-(2-methyl-5-propan-2-ylphenoxy)acetamide
CID 42966353
ethyl 4-[[2-(2-methyl-5-propan-2-ylphenoxy)acetyl]amino]benzoate
CID 7128264
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-methyl-5-propan-2-ylphenoxy)acetamide
CID 16545149

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide?
The IUPAC name of 2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide (CID 78906214) is 2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide is Cc1ccc(C(C)C)cc1OCC(=O)NC(C)C.
What is the InChIKey of 2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide?
The InChIKey is AKPQSOFNROQFIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-10(2)13-7-6-12(5)14(8-13)18-9-15(17)16-11(3)4/h6-8,10-11H,9H2,1-5H3,(H,16,17).
What are the key properties of 2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide?
2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide has a molecular weight of 249.35 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-5-propan-2-ylphenoxy)-N-propan-2-ylacetamide is sourced from PubChem (CID 78906214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).