2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide

C19H23NO2 — CID 17328158

IUPAC2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide
SMILESCCC(NC(=O)COc1ccc(C)cc1C)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-4-17(16-8-6-5-7-9-16)20-19(21)13-22-18-11-10-14(2)12-15(18)3/h5-12,17H,4,13H2,1-3H3,(H,20,21)
InChIKeyAFHVKEQSPPKWSL-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.95
Rot. Bonds6

About 2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide

2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide (PubChem CID 17328158) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide
PubChem CID17328158
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide
SMILESCCC(NC(=O)COc1ccc(C)cc1C)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-4-17(16-8-6-5-7-9-16)20-19(21)13-22-18-11-10-14(2)12-15(18)3/h5-12,17H,4,13H2,1-3H3,(H,20,21)
InChIKeyAFHVKEQSPPKWSL-UHFFFAOYSA-N
XLogP3.95
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-dimethylphenoxy)-N-[(1R)-1-(4-methoxy-3-methylphenyl)propyl]acetamide
CID 100761254
[2-[[(1R)-1-(4-methylphenyl)propyl]amino]-2-oxoethyl] 2-(2,4-dimethylphenoxy)acetate
CID 7814195
3-[[2-(2,5-dimethylphenoxy)acetyl]amino]-3-phenylpropanoic acid
CID 45461286
N-[(1S)-1-(4-methylphenyl)propyl]-2-phenoxyacetamide
CID 27754182
2-(2,4-dimethylphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]acetamide
CID 55749941
2-(2,5-dimethylphenoxy)-N-[1-(4-methoxy-3-methylphenyl)propyl]acetamide
CID 133251910
N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]-2-(2-methylphenoxy)acetamide
CID 99993393
2-(2,4-dimethylphenoxy)-N-(3,3-diphenylpropyl)acetamide
CID 39939589
2-(2,5-dimethylphenoxy)-N-[(1R)-2-[(R)-methylsulfinyl]-1-phenylethyl]acetamide
CID 95778372
2-[[2-(2,4-dimethylphenoxy)acetyl]amino]pentanoic acid
CID 43630685
2-(1-formylnaphthalen-2-yl)oxy-N-[(1R)-1-(4-methylphenyl)propyl]acetamide
CID 7763232
N-[1-(4-methylphenyl)propyl]-2-(2-propan-2-ylphenoxy)acetamide
CID 17328368

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide?
The IUPAC name of 2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide (CID 17328158) is 2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide.
What is the SMILES notation for 2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide?
The canonical SMILES for 2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide is CCC(NC(=O)COc1ccc(C)cc1C)c1ccccc1.
What is the InChIKey of 2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide?
The InChIKey is AFHVKEQSPPKWSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-4-17(16-8-6-5-7-9-16)20-19(21)13-22-18-11-10-14(2)12-15(18)3/h5-12,17H,4,13H2,1-3H3,(H,20,21).
What are the key properties of 2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide?
2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide has a molecular weight of 297.40 g/mol, XLogP of 3.95, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide is sourced from PubChem (CID 17328158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).