(2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide

C17H18FNO3 — CID 92675443

IUPAC(2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide
SMILESCOc1cccc(O[C@H](C)C(=O)NCc2ccc(F)cc2)c1
InChIInChI=1S/C17H18FNO3/c1-12(22-16-5-3-4-15(10-16)21-2)17(20)19-11-13-6-8-14(18)9-7-13/h3-10,12H,11H2,1-2H3,(H,19,20)/t12-/m1/s1
InChIKeyJYXVIKLLYXFIDA-GFCCVEGCSA-N
MW303.33 g/mol
LogP2.92
Rot. Bonds6

About (2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide

(2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide (PubChem CID 92675443) has the molecular formula C17H18FNO3 and a molecular weight of 303.33 g/mol. Its IUPAC name is (2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide
PubChem CID92675443
Molecular FormulaC17H18FNO3
Molecular Weight303.33 g/mol
Exact Mass303.13
IUPAC Name(2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide
SMILESCOc1cccc(O[C@H](C)C(=O)NCc2ccc(F)cc2)c1
InChIInChI=1S/C17H18FNO3/c1-12(22-16-5-3-4-15(10-16)21-2)17(20)19-11-13-6-8-14(18)9-7-13/h3-10,12H,11H2,1-2H3,(H,19,20)/t12-/m1/s1
InChIKeyJYXVIKLLYXFIDA-GFCCVEGCSA-N
XLogP2.92
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(3-fluorophenoxy)-N-[(4-methoxyphenyl)methyl]propanamide
CID 7834533
2-(3-acetylphenoxy)-N-[(4-fluorophenyl)methyl]propanamide
CID 51235146
(2S)-N-[(4-methoxyphenyl)methyl]-2-phenoxypropanamide
CID 831480
(2R)-2-(3-methoxyphenoxy)-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide
CID 99959505
(2S)-2-(3-methoxyphenoxy)-N-[[3-(trifluoromethyl)phenyl]methyl]propanamide
CID 100704874
(2R)-2-(4-fluorophenoxy)-N-[3-(3-methoxyphenyl)propyl]propanamide
CID 95172603
methyl 4-[[[(2S)-2-(4-fluorophenoxy)propanoyl]amino]methyl]benzoate
CID 40881969
(2R)-2-(2-fluorophenoxy)-N-[(4-methoxyphenyl)methyl]propanamide
CID 7892059
(2R)-N-[(3-ethoxyphenyl)methyl]-2-(4-fluorophenoxy)propanamide
CID 28567347
(2S)-2-(3-methoxyphenoxy)-N-propylpropanamide
CID 30392232
(2R)-N-[(4-imidazol-1-ylphenyl)methyl]-2-(3-methoxyphenoxy)propanamide
CID 28574947
(2S)-2-(3-methoxyphenoxy)-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]propanamide
CID 92676020

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide?
The IUPAC name of (2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide (CID 92675443) is (2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide.
What is the SMILES notation for (2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide?
The canonical SMILES for (2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide is COc1cccc(O[C@H](C)C(=O)NCc2ccc(F)cc2)c1.
What is the InChIKey of (2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide?
The InChIKey is JYXVIKLLYXFIDA-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H18FNO3/c1-12(22-16-5-3-4-15(10-16)21-2)17(20)19-11-13-6-8-14(18)9-7-13/h3-10,12H,11H2,1-2H3,(H,19,20)/t12-/m1/s1.
What are the key properties of (2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide?
(2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide has a molecular weight of 303.33 g/mol, XLogP of 2.92, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(4-fluorophenyl)methyl]-2-(3-methoxyphenoxy)propanamide is sourced from PubChem (CID 92675443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).