2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide

C20H24N2O3 — CID 54817171

IUPAC2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide
SMILESC=C(C)COc1ccc(NC(=O)CNc2ccccc2OCC)cc1
InChIInChI=1S/C20H24N2O3/c1-4-24-19-8-6-5-7-18(19)21-13-20(23)22-16-9-11-17(12-10-16)25-14-15(2)3/h5-12,21H,2,4,13-14H2,1,3H3,(H,22,23)
InChIKeyBALKJJGPMFSLQC-UHFFFAOYSA-N
MW340.42 g/mol
LogP4.09
Rot. Bonds9

About 2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide

2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide (PubChem CID 54817171) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide
PubChem CID54817171
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide
SMILESC=C(C)COc1ccc(NC(=O)CNc2ccccc2OCC)cc1
InChIInChI=1S/C20H24N2O3/c1-4-24-19-8-6-5-7-18(19)21-13-20(23)22-16-9-11-17(12-10-16)25-14-15(2)3/h5-12,21H,2,4,13-14H2,1,3H3,(H,22,23)
InChIKeyBALKJJGPMFSLQC-UHFFFAOYSA-N
XLogP4.09
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-methylprop-2-enoxy)anilino]-N-(4-prop-2-enoxyphenyl)acetamide
CID 54825856
2-(2-ethoxyanilino)-N-(4-methoxyphenyl)acetamide
CID 26438880
N-(4-ethoxyphenyl)-2-(2-methoxyanilino)acetamide
CID 9080558
2-(2-ethoxyanilino)-N-[4-(3-methylbutoxy)phenyl]acetamide
CID 54817368
N-(3,4-dimethylphenyl)-2-[2-(2-methylprop-2-enoxy)anilino]acetamide
CID 54825918
2-[2-(2-ethoxyethoxy)anilino]-N-[3-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54827380
N-[4-[acetyl(methyl)amino]phenyl]-2-[2-(2-methylprop-2-enoxy)anilino]acetamide
CID 54825984
2-[2-(2-methylprop-2-enoxy)anilino]-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54826186
2-(4-heptoxyanilino)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54821930
2-(2,5-dimethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54814050
2-[2-(2-ethoxyethoxy)anilino]-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54827379
N-[2-(2-methylprop-2-enoxy)phenyl]-2-(4-propan-2-yloxyanilino)acetamide
CID 54822255

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide?
The IUPAC name of 2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide (CID 54817171) is 2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide?
The canonical SMILES for 2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide is C=C(C)COc1ccc(NC(=O)CNc2ccccc2OCC)cc1.
What is the InChIKey of 2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide?
The InChIKey is BALKJJGPMFSLQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-4-24-19-8-6-5-7-18(19)21-13-20(23)22-16-9-11-17(12-10-16)25-14-15(2)3/h5-12,21H,2,4,13-14H2,1,3H3,(H,22,23).
What are the key properties of 2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide?
2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide has a molecular weight of 340.42 g/mol, XLogP of 4.09, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide is sourced from PubChem (CID 54817171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).