2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide

C20H23NO3 — CID 17113230

IUPAC2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide
SMILESC=C(C)COc1ccccc1NC(=O)COc1ccc(C)c(C)c1
InChIInChI=1S/C20H23NO3/c1-14(2)12-24-19-8-6-5-7-18(19)21-20(22)13-23-17-10-9-15(3)16(4)11-17/h5-11H,1,12-13H2,2-4H3,(H,21,22)
InChIKeyRUGPLAKZEDQJQE-UHFFFAOYSA-N
MW325.41 g/mol
LogP4.28
Rot. Bonds7

About 2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide

2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide (PubChem CID 17113230) has the molecular formula C20H23NO3 and a molecular weight of 325.41 g/mol. Its IUPAC name is 2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide
PubChem CID17113230
Molecular FormulaC20H23NO3
Molecular Weight325.41 g/mol
Exact Mass325.17
IUPAC Name2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide
SMILESC=C(C)COc1ccccc1NC(=O)COc1ccc(C)c(C)c1
InChIInChI=1S/C20H23NO3/c1-14(2)12-24-19-8-6-5-7-18(19)21-20(22)13-23-17-10-9-15(3)16(4)11-17/h5-11H,1,12-13H2,2-4H3,(H,21,22)
InChIKeyRUGPLAKZEDQJQE-UHFFFAOYSA-N
XLogP4.28
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(3,4-dimethylphenoxy)-N-(2-phenylmethoxyphenyl)acetamide
CID 17093514
2-(3,4-dimethylphenoxy)-N-(2-phenoxyphenyl)acetamide
CID 21368284
2-(4-ethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide
CID 17113216
N-(3-acetamido-2-methylphenyl)-2-(3,4-dimethylphenoxy)acetamide
CID 134019332
N-(3,4-dimethylphenyl)-2-[2-(2-methylprop-2-enoxy)anilino]acetamide
CID 54825918
N-(2-methoxyphenyl)-2-[2-(2-methylprop-2-enoxy)anilino]acetamide
CID 54826050
2-(4-chloro-3,5-dimethylphenoxy)-N-(2-methoxyphenyl)acetamide
CID 776798
2-(3,4-dimethylphenoxy)-N-(2-methylsulfonylphenyl)acetamide
CID 9137896
2-(3,4-dimethylphenoxy)-N-[2-(4-methylanilino)phenyl]acetamide
CID 108767360
2-(4-chloro-3-methylphenoxy)-N-[2-(2-ethoxyethoxy)phenyl]acetamide
CID 17134013
2-(2-acetamidophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 2472167
2-(4-chloro-3-methylphenoxy)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
CID 17130812

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide?
The IUPAC name of 2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide (CID 17113230) is 2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide.
What is the SMILES notation for 2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide?
The canonical SMILES for 2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide is C=C(C)COc1ccccc1NC(=O)COc1ccc(C)c(C)c1.
What is the InChIKey of 2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide?
The InChIKey is RUGPLAKZEDQJQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO3/c1-14(2)12-24-19-8-6-5-7-18(19)21-20(22)13-23-17-10-9-15(3)16(4)11-17/h5-11H,1,12-13H2,2-4H3,(H,21,22).
What are the key properties of 2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide?
2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide has a molecular weight of 325.41 g/mol, XLogP of 4.28, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide is sourced from PubChem (CID 17113230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).