N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide

C15H21NO2 — CID 78762140

IUPACN-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(CC)C(=O)COc1ccc(C)cc1
InChIInChI=1S/C15H21NO2/c1-5-16(10-12(2)3)15(17)11-18-14-8-6-13(4)7-9-14/h6-9H,2,5,10-11H2,1,3-4H3
InChIKeyRDTIJOLYKXLCSF-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.80
Rot. Bonds6

About N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide

N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide (PubChem CID 78762140) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide
PubChem CID78762140
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(CC)C(=O)COc1ccc(C)cc1
InChIInChI=1S/C15H21NO2/c1-5-16(10-12(2)3)15(17)11-18-14-8-6-13(4)7-9-14/h6-9H,2,5,10-11H2,1,3-4H3
InChIKeyRDTIJOLYKXLCSF-UHFFFAOYSA-N
XLogP2.80
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

[2-[ethyl(2-methylprop-2-enyl)amino]-2-oxoethyl] 3-(4-methylphenoxy)propanoate
CID 55317010
N-ethyl-N-(2-methylprop-2-enyl)-2-(4-methylsulfonylphenoxy)acetamide
CID 78790698
2-(2,3-dihydro-1H-inden-5-yloxy)-N-ethyl-N-(2-methylprop-2-enyl)acetamide
CID 84602202
N-(cyclohexylmethyl)-N-ethyl-2-(4-methylphenoxy)acetamide
CID 67511309
2-[ethyl-[2-(4-methoxyphenoxy)acetyl]amino]acetic acid
CID 54900881
2-(2-acetylphenoxy)-N-ethyl-N-(2-methylprop-2-enyl)acetamide
CID 112781553
2-(2,6-dimethoxyphenoxy)-N-ethyl-N-(2-methylprop-2-enyl)acetamide
CID 78767254
2-(2-chlorophenoxy)-N-ethyl-N-(2-methylprop-2-enyl)acetamide
CID 78762100
N-methoxy-N-methyl-2-(4-methylphenoxy)acetamide
CID 59178255
N,N-diethyl-2-(4-sulfanylphenoxy)acetamide
CID 23092623
3-[[2-(4-methylphenoxy)acetyl]-propylamino]propanoic acid
CID 82325601
methyl 2-[[2-(4-aminophenoxy)acetyl]-ethylamino]acetate
CID 54998119

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide?
The IUPAC name of N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide (CID 78762140) is N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide.
What is the SMILES notation for N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide?
The canonical SMILES for N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide is C=C(C)CN(CC)C(=O)COc1ccc(C)cc1.
What is the InChIKey of N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide?
The InChIKey is RDTIJOLYKXLCSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-5-16(10-12(2)3)15(17)11-18-14-8-6-13(4)7-9-14/h6-9H,2,5,10-11H2,1,3-4H3.
What are the key properties of N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide?
N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide has a molecular weight of 247.34 g/mol, XLogP of 2.80, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-methylphenoxy)-N-(2-methylprop-2-enyl)acetamide is sourced from PubChem (CID 78762140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).