(2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide

C18H20FNO3 — CID 37363339

IUPAC(2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide
SMILESCc1cccc(O[C@H](C)C(=O)NCCOc2ccc(F)cc2)c1
InChIInChI=1S/C18H20FNO3/c1-13-4-3-5-17(12-13)23-14(2)18(21)20-10-11-22-16-8-6-15(19)7-9-16/h3-9,12,14H,10-11H2,1-2H3,(H,20,21)/t14-/m1/s1
InChIKeyWUXXRZZEXRHNDO-CQSZACIVSA-N
MW317.36 g/mol
LogP3.10
Rot. Bonds7

About (2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide

(2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide (PubChem CID 37363339) has the molecular formula C18H20FNO3 and a molecular weight of 317.36 g/mol. Its IUPAC name is (2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide
PubChem CID37363339
Molecular FormulaC18H20FNO3
Molecular Weight317.36 g/mol
Exact Mass317.14
IUPAC Name(2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide
SMILESCc1cccc(O[C@H](C)C(=O)NCCOc2ccc(F)cc2)c1
InChIInChI=1S/C18H20FNO3/c1-13-4-3-5-17(12-13)23-14(2)18(21)20-10-11-22-16-8-6-15(19)7-9-16/h3-9,12,14H,10-11H2,1-2H3,(H,20,21)/t14-/m1/s1
InChIKeyWUXXRZZEXRHNDO-CQSZACIVSA-N
XLogP3.10
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.36
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-[2-(3,5-dimethylphenoxy)ethyl]-2-(4-fluorophenoxy)propanamide
CID 95161756
(2S)-2-(3-fluorophenoxy)-N-(2-phenoxyethyl)propanamide
CID 30865784
(2R)-N-[2-(2-methoxyphenoxy)ethyl]-2-(3-methylphenoxy)propanamide
CID 38451380
N-[2-(2,3-dimethylphenoxy)ethyl]-2-(3-methylphenoxy)propanamide
CID 133165885
2-(2-methoxyphenoxy)-N-[2-(3-methylphenoxy)ethyl]propanamide
CID 133219180
(2S)-2-(4-fluorophenoxy)-N'-[3-(3-methylphenoxy)propanoyl]propanehydrazide
CID 7964944
(2S)-2-(3-chlorophenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide
CID 30794885
(2R)-2-(4-fluorophenoxy)-N-[2-(2-methylphenoxy)ethyl]propanamide
CID 94633905
2-(3-methylphenoxy)-N-[2-(4-pyrrolidin-1-ylsulfonylphenoxy)ethyl]propanamide
CID 133240632
2-(4-fluorophenoxy)-N'-[2-(3-methylphenoxy)acetyl]propanehydrazide
CID 24638267
(2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 100562896
N-[2-(3-methylphenoxy)ethyl]-2-(2,3,5-trimethylphenoxy)propanamide
CID 133239821

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide?
The IUPAC name of (2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide (CID 37363339) is (2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide?
The canonical SMILES for (2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide is Cc1cccc(O[C@H](C)C(=O)NCCOc2ccc(F)cc2)c1.
What is the InChIKey of (2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide?
The InChIKey is WUXXRZZEXRHNDO-CQSZACIVSA-N. The full InChI is InChI=1S/C18H20FNO3/c1-13-4-3-5-17(12-13)23-14(2)18(21)20-10-11-22-16-8-6-15(19)7-9-16/h3-9,12,14H,10-11H2,1-2H3,(H,20,21)/t14-/m1/s1.
What are the key properties of (2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide?
(2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide has a molecular weight of 317.36 g/mol, XLogP of 3.10, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(4-fluorophenoxy)ethyl]-2-(3-methylphenoxy)propanamide is sourced from PubChem (CID 37363339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).