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

C16H16FNO2 — CID 9413689

IUPACN-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide
SMILESCc1cccc(OCCC(=O)Nc2ccccc2F)c1
InChIInChI=1S/C16H16FNO2/c1-12-5-4-6-13(11-12)20-10-9-16(19)18-15-8-3-2-7-14(15)17/h2-8,11H,9-10H2,1H3,(H,18,19)
InChIKeyACJNXSZTFQUVEW-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.54
Rot. Bonds5

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

N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide (PubChem CID 9413689) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide
PubChem CID9413689
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC NameN-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide
SMILESCc1cccc(OCCC(=O)Nc2ccccc2F)c1
InChIInChI=1S/C16H16FNO2/c1-12-5-4-6-13(11-12)20-10-9-16(19)18-15-8-3-2-7-14(15)17/h2-8,11H,9-10H2,1H3,(H,18,19)
InChIKeyACJNXSZTFQUVEW-UHFFFAOYSA-N
XLogP3.54
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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

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Related Compounds

N-(2-fluoro-5-methylphenyl)-3-(3-methylphenoxy)propanamide
CID 808300
N-(2-fluorophenyl)-2-(3-methylphenoxy)acetamide
CID 723312
N-[2-(bromomethyl)phenyl]-3-(3-methylphenoxy)propanamide
CID 114309727
N-(2-ethoxyphenyl)-3-(3-methylphenoxy)propanamide
CID 2939056
N-(2-bromo-4-methylphenyl)-3-(3-methylphenoxy)propanamide
CID 17395169
N-[2-(ethylaminomethyl)phenyl]-3-(3-methylphenoxy)propanamide
CID 119439844
3-(4-fluorophenoxy)-N-(2-fluorophenyl)propanamide
CID 38765188
N-(2-bromo-5-methylphenyl)-3-(3-methylphenoxy)propanamide
CID 82712318
N-(4-chlorophenyl)-3-(3-methylphenoxy)propanamide
CID 7965845
N-(2-methoxyphenyl)-4-(3-methylphenoxy)butanamide
CID 19173646
4-(3-methylphenoxy)-N-(2-propan-2-ylphenyl)butanamide
CID 19173643
4-(3-methylphenoxy)-N-(2-propoxyphenyl)butanamide
CID 112793578

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide?
The IUPAC name of N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide (CID 9413689) is N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide.
What is the SMILES notation for N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide?
The canonical SMILES for N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide is Cc1cccc(OCCC(=O)Nc2ccccc2F)c1.
What is the InChIKey of N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide?
The InChIKey is ACJNXSZTFQUVEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c1-12-5-4-6-13(11-12)20-10-9-16(19)18-15-8-3-2-7-14(15)17/h2-8,11H,9-10H2,1H3,(H,18,19).
What are the key properties of N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide?
N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide has a molecular weight of 273.31 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-3-(3-methylphenoxy)propanamide is sourced from PubChem (CID 9413689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).