3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide

C20H24FNO2 — CID 18208025

IUPAC3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide
SMILESCc1ccc(F)cc1NC(=O)CCOc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C20H24FNO2/c1-14-5-8-16(21)13-18(14)22-19(23)11-12-24-17-9-6-15(7-10-17)20(2,3)4/h5-10,13H,11-12H2,1-4H3,(H,22,23)
InChIKeyOYPALAMQSSAZAM-UHFFFAOYSA-N
MW329.42 g/mol
LogP4.84
Rot. Bonds5

About 3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide

3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide (PubChem CID 18208025) has the molecular formula C20H24FNO2 and a molecular weight of 329.42 g/mol. Its IUPAC name is 3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide.

Molecular Properties

Compound Name3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide
PubChem CID18208025
Molecular FormulaC20H24FNO2
Molecular Weight329.42 g/mol
Exact Mass329.18
IUPAC Name3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide
SMILESCc1ccc(F)cc1NC(=O)CCOc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C20H24FNO2/c1-14-5-8-16(21)13-18(14)22-19(23)11-12-24-17-9-6-15(7-10-17)20(2,3)4/h5-10,13H,11-12H2,1-4H3,(H,22,23)
InChIKeyOYPALAMQSSAZAM-UHFFFAOYSA-N
XLogP4.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.42
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)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

N-(2,5-dimethylphenyl)-3-(4-fluorophenoxy)propanamide
CID 31847881
3-(3,5-dimethylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide
CID 35504455
4-[(4-tert-butylphenoxy)methyl]-N-(5-fluoro-2-methylphenyl)benzamide
CID 7961623
3-[(4-tert-butylphenyl)sulfonylamino]-N-(5-fluoro-2-methylphenyl)propanamide
CID 9211693
2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 42989700
3-(4-tert-butylphenoxy)-N-(4-methylphenyl)propanamide
CID 18266665
2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 804157
N-(2-fluoro-4-methylphenyl)-3-(4-fluorophenoxy)propanamide
CID 31893094
2-amino-N-(5-fluoro-2-methylphenyl)acetamide
CID 24700155
4-(4-fluorophenoxy)-N-(2-methylphenyl)butanamide
CID 86919949
2-(4-cyanophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 7961641
N-(5-fluoro-2-methylphenyl)-4-(4-methoxyphenyl)butanamide
CID 798892

Frequently Asked Questions

What is the IUPAC name of 3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide?
The IUPAC name of 3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide (CID 18208025) is 3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide.
What is the SMILES notation for 3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide?
The canonical SMILES for 3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide is Cc1ccc(F)cc1NC(=O)CCOc1ccc(C(C)(C)C)cc1.
What is the InChIKey of 3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide?
The InChIKey is OYPALAMQSSAZAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FNO2/c1-14-5-8-16(21)13-18(14)22-19(23)11-12-24-17-9-6-15(7-10-17)20(2,3)4/h5-10,13H,11-12H2,1-4H3,(H,22,23).
What are the key properties of 3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide?
3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide has a molecular weight of 329.42 g/mol, XLogP of 4.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide is sourced from PubChem (CID 18208025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).