3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide

C17H18FNO2 — CID 71104305

IUPAC3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide
SMILESCOc1c(C)cccc1NC(=O)CCc1ccc(F)cc1
InChIInChI=1S/C17H18FNO2/c1-12-4-3-5-15(17(12)21-2)19-16(20)11-8-13-6-9-14(18)10-7-13/h3-7,9-10H,8,11H2,1-2H3,(H,19,20)
InChIKeyFQTACXRIUPXLFO-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.71
Rot. Bonds5

About 3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide

3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide (PubChem CID 71104305) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide
PubChem CID71104305
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC Name3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide
SMILESCOc1c(C)cccc1NC(=O)CCc1ccc(F)cc1
InChIInChI=1S/C17H18FNO2/c1-12-4-3-5-15(17(12)21-2)19-16(20)11-8-13-6-9-14(18)10-7-13/h3-7,9-10H,8,11H2,1-2H3,(H,19,20)
InChIKeyFQTACXRIUPXLFO-UHFFFAOYSA-N
XLogP3.71
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(4-fluorophenyl)-N-(2-methoxy-3-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

methyl 2-[3-(4-fluorophenyl)propanoylamino]benzoate
CID 32989548
ethyl 2-[3-(4-fluorophenyl)propanoylamino]benzoate
CID 27844298
N-(2,3-dimethylphenyl)-3-[2-(4-fluorophenyl)ethylamino]propanamide
CID 109025134
N-(2-bromophenyl)-3-(4-fluorophenyl)propanamide
CID 51194781
N-(2,4-dimethoxyphenyl)-3-(4-fluorophenyl)propanamide
CID 27844760
N-(4-fluoro-2-methylphenyl)-3-phenylpropanamide
CID 7751880
3-(4-aminophenyl)-N-(2,3-dimethylphenyl)propanamide
CID 28713065
3-(4-fluorophenyl)-N-[2-[(2,2,2-trifluoroacetyl)amino]phenyl]propanamide
CID 108933554
3-phenyl-N-[5-(3-phenylpropanoylamino)naphthalen-1-yl]propanamide
CID 1010239
3-(4-aminophenyl)-N-(2-methoxyphenyl)propanamide
CID 28713140
N-(2-fluorophenyl)-3-(3,4,5-trimethoxyphenyl)propanamide
CID 2710290
3-(4-fluorophenyl)-N-[(3-methoxyphenyl)methyl]propanamide
CID 43030428

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide?
The IUPAC name of 3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide (CID 71104305) is 3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide.
What is the SMILES notation for 3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide?
The canonical SMILES for 3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide is COc1c(C)cccc1NC(=O)CCc1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide?
The InChIKey is FQTACXRIUPXLFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-12-4-3-5-15(17(12)21-2)19-16(20)11-8-13-6-9-14(18)10-7-13/h3-7,9-10H,8,11H2,1-2H3,(H,19,20).
What are the key properties of 3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide?
3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide has a molecular weight of 287.33 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-(2-methoxy-3-methylphenyl)propanamide is sourced from PubChem (CID 71104305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).