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

C18H20FNO3 — CID 31997887

IUPAC3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide
SMILESCCCOc1ccccc1NC(=O)CCOc1ccc(F)cc1
InChIInChI=1S/C18H20FNO3/c1-2-12-23-17-6-4-3-5-16(17)20-18(21)11-13-22-15-9-7-14(19)8-10-15/h3-10H,2,11-13H2,1H3,(H,20,21)
InChIKeyIDTJPQBQPRDAKX-UHFFFAOYSA-N
MW317.36 g/mol
LogP4.02
Rot. Bonds8

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

3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide (PubChem CID 31997887) has the molecular formula C18H20FNO3 and a molecular weight of 317.36 g/mol. Its IUPAC name is 3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide.

Molecular Properties

Compound Name3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide
PubChem CID31997887
Molecular FormulaC18H20FNO3
Molecular Weight317.36 g/mol
Exact Mass317.14
IUPAC Name3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide
SMILESCCCOc1ccccc1NC(=O)CCOc1ccc(F)cc1
InChIInChI=1S/C18H20FNO3/c1-2-12-23-17-6-4-3-5-16(17)20-18(21)11-13-22-15-9-7-14(19)8-10-15/h3-10H,2,11-13H2,1H3,(H,20,21)
InChIKeyIDTJPQBQPRDAKX-UHFFFAOYSA-N
XLogP4.02
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.36
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-butoxyphenyl)-3-(4-fluorophenoxy)propanamide
CID 55906665
N-(2-ethoxyphenyl)-3-(4-fluorophenoxy)propanamide
CID 31895143
3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide
CID 38765188
3-(4-fluorophenoxy)-N-(2-methylsulfanylphenyl)propanamide
CID 31891666
N-[2-[2-(4-fluorophenoxy)ethoxy]phenyl]acetamide
CID 7506171
3-amino-N-(2-propoxyphenyl)propanamide;hydrochloride
CID 119268305
N,N'-bis(2-butoxyphenyl)hexanediamide
CID 17087317
N-(2-ethoxyphenyl)-2-(4-fluorophenoxy)acetamide
CID 727173
5-chloro-N-(2-propoxyphenyl)pentanamide
CID 43697480
N-(2-butoxyphenyl)tetradecanamide
CID 54789601
N-[2-(2-phenoxyethoxy)phenyl]-2-(4-propoxyanilino)acetamide
CID 54820282
4-(4-fluorophenoxy)-N-(2-methylphenyl)butanamide
CID 86919949

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide?
The IUPAC name of 3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide (CID 31997887) is 3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide.
What is the SMILES notation for 3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide?
The canonical SMILES for 3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide is CCCOc1ccccc1NC(=O)CCOc1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide?
The InChIKey is IDTJPQBQPRDAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO3/c1-2-12-23-17-6-4-3-5-16(17)20-18(21)11-13-22-15-9-7-14(19)8-10-15/h3-10H,2,11-13H2,1H3,(H,20,21).
What are the key properties of 3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide?
3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide has a molecular weight of 317.36 g/mol, XLogP of 4.02, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenoxy)-N-(2-propoxyphenyl)propanamide is sourced from PubChem (CID 31997887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).