N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide

C17H18FNO2 — CID 808300

IUPACN-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide
SMILESCc1cccc(OCCC(=O)Nc2cc(C)ccc2F)c1
InChIInChI=1S/C17H18FNO2/c1-12-4-3-5-14(10-12)21-9-8-17(20)19-16-11-13(2)6-7-15(16)18/h3-7,10-11H,8-9H2,1-2H3,(H,19,20)
InChIKeyFOTZODRQGLEEKA-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.85
Rot. Bonds5

About N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide

N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide (PubChem CID 808300) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide.

Molecular Properties

Compound NameN-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide
PubChem CID808300
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC NameN-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide
SMILESCc1cccc(OCCC(=O)Nc2cc(C)ccc2F)c1
InChIInChI=1S/C17H18FNO2/c1-12-4-3-5-14(10-12)21-9-8-17(20)19-16-11-13(2)6-7-15(16)18/h3-7,10-11H,8-9H2,1-2H3,(H,19,20)
InChIKeyFOTZODRQGLEEKA-UHFFFAOYSA-N
XLogP3.85
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 ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide
CID 9413689
N-(2-bromo-5-methylphenyl)-3-(3-methylphenoxy)propanamide
CID 82712318
N-(2-bromo-4-methylphenyl)-3-(3-methylphenoxy)propanamide
CID 17395169
N-(4-chlorophenyl)-3-(3-methylphenoxy)propanamide
CID 7965845
[2-(5-chloro-2-fluoroanilino)-2-oxoethyl] 4-(3-methylphenoxy)butanoate
CID 7147965
N-[2-(bromomethyl)phenyl]-3-(3-methylphenoxy)propanamide
CID 114309727
N-(2-ethoxyphenyl)-3-(3-methylphenoxy)propanamide
CID 2939056
4-(4-acetylphenoxy)-N-(2-fluoro-5-methylphenyl)butanamide
CID 78769431
N-(2-fluorophenyl)-2-(3-methylphenoxy)acetamide
CID 723312
N-(6-bromo-2-methyl-3-pyridinyl)-3-(3-methylphenoxy)propanamide
CID 103909587
N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide
CID 119439844
N-(2,5-dimethylphenyl)-3-(4-fluorophenoxy)propanamide
CID 31847881

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide?
The IUPAC name of N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide (CID 808300) is N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide is Cc1cccc(OCCC(=O)Nc2cc(C)ccc2F)c1.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide?
The InChIKey is FOTZODRQGLEEKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-12-4-3-5-14(10-12)21-9-8-17(20)19-16-11-13(2)6-7-15(16)18/h3-7,10-11H,8-9H2,1-2H3,(H,19,20).
What are the key properties of N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide?
N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide has a molecular weight of 287.33 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide is sourced from PubChem (CID 808300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).