(2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide

C18H20FNO2 — CID 26074940

IUPAC(2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide
SMILESCc1cc(C)c(NC(=O)[C@H](C)Oc2ccc(F)cc2)c(C)c1
InChIInChI=1S/C18H20FNO2/c1-11-9-12(2)17(13(3)10-11)20-18(21)14(4)22-16-7-5-15(19)6-8-16/h5-10,14H,1-4H3,(H,20,21)/t14-/m0/s1
InChIKeyNNQSLYIWIHGVEA-AWEZNQCLSA-N
MW301.36 g/mol
LogP4.16
Rot. Bonds4

About (2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide

(2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide (PubChem CID 26074940) has the molecular formula C18H20FNO2 and a molecular weight of 301.36 g/mol. Its IUPAC name is (2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide
PubChem CID26074940
Molecular FormulaC18H20FNO2
Molecular Weight301.36 g/mol
Exact Mass301.15
IUPAC Name(2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide
SMILESCc1cc(C)c(NC(=O)[C@H](C)Oc2ccc(F)cc2)c(C)c1
InChIInChI=1S/C18H20FNO2/c1-11-9-12(2)17(13(3)10-11)20-18(21)14(4)22-16-7-5-15(19)6-8-16/h5-10,14H,1-4H3,(H,20,21)/t14-/m0/s1
InChIKeyNNQSLYIWIHGVEA-AWEZNQCLSA-N
XLogP4.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.36
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)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

(2S)-2-[4-(4-fluorobenzoyl)phenoxy]-N-(2,4,6-trimethylphenyl)propanamide
CID 7795231
(2S)-N-(2,6-dimethylphenyl)-2-(4-fluorophenoxy)propanamide
CID 51473397
(2S)-2-(4-chlorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 8760048
N-(3,5-dimethylphenyl)-2-(4-fluorophenoxy)propanamide
CID 21173898
2-(3,5-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 53266252
(2R)-2-(4-chloro-3-methylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 7794811
(2S)-N-(5-fluoro-2-methylphenyl)-2-(4-fluorophenoxy)propanamide
CID 9097735
N-(2-chloro-4,6-dimethylphenyl)-2-(4-methoxyphenoxy)propanamide
CID 53265828
(2R)-2-(3,5-dimethylphenoxy)-N-(4-fluorophenyl)propanamide
CID 9173132
(2R)-2-(4-fluorophenoxy)-N-(3-methylphenyl)propanamide
CID 26218148
(2R)-2-(4-fluorophenoxy)-N-(2-methylphenyl)propanamide
CID 7946714
(2S)-2-(2,4-dimethylphenoxy)-N-(2,4,6-trimethylphenyl)propanamide
CID 837680

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide?
The IUPAC name of (2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide (CID 26074940) is (2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide.
What is the SMILES notation for (2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide?
The canonical SMILES for (2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide is Cc1cc(C)c(NC(=O)[C@H](C)Oc2ccc(F)cc2)c(C)c1.
What is the InChIKey of (2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide?
The InChIKey is NNQSLYIWIHGVEA-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H20FNO2/c1-11-9-12(2)17(13(3)10-11)20-18(21)14(4)22-16-7-5-15(19)6-8-16/h5-10,14H,1-4H3,(H,20,21)/t14-/m0/s1.
What are the key properties of (2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide?
(2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide has a molecular weight of 301.36 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-fluorophenoxy)-N-(2,4,6-trimethylphenyl)propanamide is sourced from PubChem (CID 26074940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).