(2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide

C16H16FNO2 — CID 2710252

IUPAC(2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide
SMILESCc1cccc(O[C@@H](C)C(=O)Nc2ccccc2F)c1
InChIInChI=1S/C16H16FNO2/c1-11-6-5-7-13(10-11)20-12(2)16(19)18-15-9-4-3-8-14(15)17/h3-10,12H,1-2H3,(H,18,19)/t12-/m0/s1
InChIKeyZKSGEGMMZKOQDV-LBPRGKRZSA-N
MW273.31 g/mol
LogP3.54
Rot. Bonds4

About (2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide

(2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide (PubChem CID 2710252) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is (2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide.

Molecular Properties

Compound Name(2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide
PubChem CID2710252
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC Name(2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide
SMILESCc1cccc(O[C@@H](C)C(=O)Nc2ccccc2F)c1
InChIInChI=1S/C16H16FNO2/c1-11-6-5-7-13(10-11)20-12(2)16(19)18-15-9-4-3-8-14(15)17/h3-10,12H,1-2H3,(H,18,19)/t12-/m0/s1
InChIKeyZKSGEGMMZKOQDV-LBPRGKRZSA-N
XLogP3.54
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide 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-(3-methylphenoxy)-N-[2-[2-(3-methylphenoxy)propanoylamino]phenyl]propanamide
CID 4211486
N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide
CID 18103927
(2R)-2-(3-methylphenoxy)-N-(2-methylphenyl)propanamide
CID 7028027
(2R)-2-(3-chlorophenoxy)-N-(2-fluorophenyl)propanamide
CID 848384
(2R)-2-(3-methylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 841227
(2R)-N-(2,3-dimethylphenyl)-2-(3-methylphenoxy)propanamide
CID 2640909
N-(2,3-dimethylphenyl)-2-(3-methylphenoxy)propanamide
CID 4931110
ethyl 3-[(2R)-1-(2-fluoroanilino)-1-oxopropan-2-yl]oxybenzoate
CID 7695121
(2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide
CID 95788721
N-(2,4-dimethylphenyl)-2-(3-methylphenoxy)propanamide
CID 4931062
N-(2-cyanophenyl)-2-(3-methylphenoxy)propanamide
CID 2989906
[(2R)-1-(2,6-difluoroanilino)-1-oxopropan-2-yl] (2R)-2-(3-methylphenoxy)propanoate
CID 8737888

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide?
The IUPAC name of (2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide (CID 2710252) is (2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide.
What is the SMILES notation for (2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide?
The canonical SMILES for (2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide is Cc1cccc(O[C@@H](C)C(=O)Nc2ccccc2F)c1.
What is the InChIKey of (2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide?
The InChIKey is ZKSGEGMMZKOQDV-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H16FNO2/c1-11-6-5-7-13(10-11)20-12(2)16(19)18-15-9-4-3-8-14(15)17/h3-10,12H,1-2H3,(H,18,19)/t12-/m0/s1.
What are the key properties of (2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide?
(2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide has a molecular weight of 273.31 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide is sourced from PubChem (CID 2710252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).