N-(2-ethylphenyl)-3-phenoxypropanamide

C17H19NO2 — CID 725624

IUPACN-(2-ethylphenyl)-3-phenoxypropanamide
SMILESCCc1ccccc1NC(=O)CCOc1ccccc1
InChIInChI=1S/C17H19NO2/c1-2-14-8-6-7-11-16(14)18-17(19)12-13-20-15-9-4-3-5-10-15/h3-11H,2,12-13H2,1H3,(H,18,19)
InChIKeyBNWBKZRVOXHUFG-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.66
Rot. Bonds6

About N-(2-ethylphenyl)-3-phenoxypropanamide

N-(2-ethylphenyl)-3-phenoxypropanamide (PubChem CID 725624) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-(2-ethylphenyl)-3-phenoxypropanamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-3-phenoxypropanamide
PubChem CID725624
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-(2-ethylphenyl)-3-phenoxypropanamide
SMILESCCc1ccccc1NC(=O)CCOc1ccccc1
InChIInChI=1S/C17H19NO2/c1-2-14-8-6-7-11-16(14)18-17(19)12-13-20-15-9-4-3-5-10-15/h3-11H,2,12-13H2,1H3,(H,18,19)
InChIKeyBNWBKZRVOXHUFG-UHFFFAOYSA-N
XLogP3.66
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-3-phenoxypropanamide?
The IUPAC name of N-(2-ethylphenyl)-3-phenoxypropanamide (CID 725624) is N-(2-ethylphenyl)-3-phenoxypropanamide.
What is the SMILES notation for N-(2-ethylphenyl)-3-phenoxypropanamide?
The canonical SMILES for N-(2-ethylphenyl)-3-phenoxypropanamide is CCc1ccccc1NC(=O)CCOc1ccccc1.
What is the InChIKey of N-(2-ethylphenyl)-3-phenoxypropanamide?
The InChIKey is BNWBKZRVOXHUFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-2-14-8-6-7-11-16(14)18-17(19)12-13-20-15-9-4-3-5-10-15/h3-11H,2,12-13H2,1H3,(H,18,19).
What are the key properties of N-(2-ethylphenyl)-3-phenoxypropanamide?
N-(2-ethylphenyl)-3-phenoxypropanamide has a molecular weight of 269.34 g/mol, XLogP of 3.66, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-3-phenoxypropanamide is sourced from PubChem (CID 725624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).