N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide

C17H18FNO3 — CID 31895143

IUPACN-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide
SMILESCCOc1ccccc1NC(=O)CCOc1ccc(F)cc1
InChIInChI=1S/C17H18FNO3/c1-2-21-16-6-4-3-5-15(16)19-17(20)11-12-22-14-9-7-13(18)8-10-14/h3-10H,2,11-12H2,1H3,(H,19,20)
InChIKeyCZJAFVUWKZDLGJ-UHFFFAOYSA-N
MW303.33 g/mol
LogP3.63
Rot. Bonds7

About N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide

N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide (PubChem CID 31895143) has the molecular formula C17H18FNO3 and a molecular weight of 303.33 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide
PubChem CID31895143
Molecular FormulaC17H18FNO3
Molecular Weight303.33 g/mol
Exact Mass303.13
IUPAC NameN-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide
SMILESCCOc1ccccc1NC(=O)CCOc1ccc(F)cc1
InChIInChI=1S/C17H18FNO3/c1-2-21-16-6-4-3-5-15(16)19-17(20)11-12-22-14-9-7-13(18)8-10-14/h3-10H,2,11-12H2,1H3,(H,19,20)
InChIKeyCZJAFVUWKZDLGJ-UHFFFAOYSA-N
XLogP3.63
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-butoxyphenyl)-3-(4-fluorophenoxy)propanamide
CID 55906665
3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide
CID 31997887
N-(2-ethoxyphenyl)-2-(4-fluorophenoxy)acetamide
CID 727173
3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide
CID 38765188
3-(4-fluorophenoxy)-N-(2-methylsulfanylphenyl)propanamide
CID 31891666
N-(2-ethoxyphenyl)-3-(3-methylphenoxy)propanamide
CID 2939056
N-[2-[2-(4-fluorophenoxy)ethoxy]phenyl]acetamide
CID 7506171
4-(2-ethoxyphenoxy)-N-(2-ethoxyphenyl)butanamide
CID 7935064
N-(2-ethoxy-4-fluorophenyl)-3-(4-nitrophenoxy)propanamide
CID 78892551
3-amino-N-(2-ethoxyphenyl)propanamide;hydrochloride
CID 119263917
4-(4-fluorophenoxy)-N-(2-methylphenyl)butanamide
CID 86919949
N-(2-ethoxyphenyl)-2-[2-(2-phenoxyethoxy)anilino]acetamide
CID 54827090

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide?
The IUPAC name of N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide (CID 31895143) is N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide?
The canonical SMILES for N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide is CCOc1ccccc1NC(=O)CCOc1ccc(F)cc1.
What is the InChIKey of N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide?
The InChIKey is CZJAFVUWKZDLGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO3/c1-2-21-16-6-4-3-5-15(16)19-17(20)11-12-22-14-9-7-13(18)8-10-14/h3-10H,2,11-12H2,1H3,(H,19,20).
What are the key properties of N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide?
N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide has a molecular weight of 303.33 g/mol, XLogP of 3.63, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide is sourced from PubChem (CID 31895143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).