(2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide

C18H20FNO2 — CID 40746709

IUPAC(2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide
SMILESCC[C@@H](Oc1ccccc1F)C(=O)Nc1c(C)cccc1C
InChIInChI=1S/C18H20FNO2/c1-4-15(22-16-11-6-5-10-14(16)19)18(21)20-17-12(2)8-7-9-13(17)3/h5-11,15H,4H2,1-3H3,(H,20,21)/t15-/m1/s1
InChIKeyPPELJUACEONSEL-OAHLLOKOSA-N
MW301.36 g/mol
LogP4.24
Rot. Bonds5

About (2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide

(2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide (PubChem CID 40746709) has the molecular formula C18H20FNO2 and a molecular weight of 301.36 g/mol. Its IUPAC name is (2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide.

Molecular Properties

Compound Name(2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide
PubChem CID40746709
Molecular FormulaC18H20FNO2
Molecular Weight301.36 g/mol
Exact Mass301.15
IUPAC Name(2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide
SMILESCC[C@@H](Oc1ccccc1F)C(=O)Nc1c(C)cccc1C
InChIInChI=1S/C18H20FNO2/c1-4-15(22-16-11-6-5-10-14(16)19)18(21)20-17-12(2)8-7-9-13(17)3/h5-11,15H,4H2,1-3H3,(H,20,21)/t15-/m1/s1
InChIKeyPPELJUACEONSEL-OAHLLOKOSA-N
XLogP4.24
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.36
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,3-dimethylphenoxy)-N-(2,6-dimethylphenyl)butanamide
CID 46770326
(2R)-2-(2-chlorophenoxy)-N-(2,6-difluorophenyl)butanamide
CID 38002090
(2R)-N-(4-acetamidophenyl)-2-(2-fluorophenoxy)butanamide
CID 9180312
N-(4-chloro-2-methylphenyl)-2-(2-fluorophenoxy)butanamide
CID 78843004
(2S)-N-(5-chloro-2-methylphenyl)-2-(2-fluorophenoxy)butanamide
CID 9173655
2-(2,4-dimethylphenoxy)-N-(2,6-dimethylphenyl)butanamide
CID 53288935
2-(2-fluorophenoxy)-N-(5-methyl-1H-1,2,4-triazol-3-yl)butanamide
CID 71863908
2-(2-fluorophenoxy)-N-propan-2-ylbutanamide
CID 53286261
N-(4-ethylphenyl)-2-(2-fluorophenoxy)butanamide
CID 53286461
(2S)-2-(2-fluorophenoxy)-N-(2-propan-2-ylphenyl)butanamide
CID 9181809
(2R)-N-(2,6-diethylphenyl)-2-(2,3-dimethylphenoxy)butanamide
CID 99955131
2-(2-methylphenoxy)-N-[2-[2-(2-methylphenoxy)butanoylamino]phenyl]butanamide
CID 4932214

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide?
The IUPAC name of (2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide (CID 40746709) is (2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide.
What is the SMILES notation for (2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide?
The canonical SMILES for (2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide is CC[C@@H](Oc1ccccc1F)C(=O)Nc1c(C)cccc1C.
What is the InChIKey of (2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide?
The InChIKey is PPELJUACEONSEL-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H20FNO2/c1-4-15(22-16-11-6-5-10-14(16)19)18(21)20-17-12(2)8-7-9-13(17)3/h5-11,15H,4H2,1-3H3,(H,20,21)/t15-/m1/s1.
What are the key properties of (2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide?
(2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide has a molecular weight of 301.36 g/mol, XLogP of 4.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2,6-dimethylphenyl)-2-(2-fluorophenoxy)butanamide is sourced from PubChem (CID 40746709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).