2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide

C19H21NO3 — CID 17097965

IUPAC2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide
SMILESC=CCOc1ccccc1NC(=O)COc1ccc(CC)cc1
InChIInChI=1S/C19H21NO3/c1-3-13-22-18-8-6-5-7-17(18)20-19(21)14-23-16-11-9-15(4-2)10-12-16/h3,5-12H,1,4,13-14H2,2H3,(H,20,21)
InChIKeyRYVTYESGXVCZKL-UHFFFAOYSA-N
MW311.38 g/mol
LogP3.83
Rot. Bonds8

About 2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide

2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide (PubChem CID 17097965) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide
PubChem CID17097965
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide
SMILESC=CCOc1ccccc1NC(=O)COc1ccc(CC)cc1
InChIInChI=1S/C19H21NO3/c1-3-13-22-18-8-6-5-7-17(18)20-19(21)14-23-16-11-9-15(4-2)10-12-16/h3,5-12H,1,4,13-14H2,2H3,(H,20,21)
InChIKeyRYVTYESGXVCZKL-UHFFFAOYSA-N
XLogP3.83
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 53.83
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-(4-ethylphenoxy)-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide
CID 17113216
2-(4-methoxyphenyl)-N-(2-prop-2-enoxyphenyl)acetamide
CID 17097941
N-(2-ethoxyphenyl)-2-(4-phenylphenoxy)acetamide
CID 7919529
2-(2-tert-butylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide
CID 17098053
N-(2-ethoxyphenyl)-2-(4-fluorophenoxy)acetamide
CID 727173
2-(4-methoxyphenyl)-N-[(2-prop-2-enoxyphenyl)carbamothioyl]acetamide
CID 17098246
N-(2-ethoxyphenyl)-2-(4-propan-2-ylphenoxy)acetamide
CID 723516
N-(2-butoxyphenyl)-2-(4-prop-2-enoxyanilino)acetamide
CID 54821544
2-(tert-butylamino)-N-(2-prop-2-enoxyphenyl)acetamide
CID 54813857
2-(propan-2-ylamino)-N-(2-prop-2-enoxyphenyl)acetamide
CID 54817694
methyl 3-[[2-(4-ethylphenoxy)acetyl]amino]-2-hydroxybenzoate
CID 56543383
2-[4-(2-phenoxyethoxy)anilino]-N-(2-prop-2-enoxyphenyl)acetamide
CID 54822803

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide (CID 17097965) is 2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide is C=CCOc1ccccc1NC(=O)COc1ccc(CC)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide?
The InChIKey is RYVTYESGXVCZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO3/c1-3-13-22-18-8-6-5-7-17(18)20-19(21)14-23-16-11-9-15(4-2)10-12-16/h3,5-12H,1,4,13-14H2,2H3,(H,20,21).
What are the key properties of 2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide?
2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide has a molecular weight of 311.38 g/mol, XLogP of 3.83, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide is sourced from PubChem (CID 17097965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).