N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide

C16H13FN2O2 — CID 64854041

IUPACN-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide
SMILESCc1ccc(F)c(OCC(=O)Nc2ccccc2C#N)c1
InChIInChI=1S/C16H13FN2O2/c1-11-6-7-13(17)15(8-11)21-10-16(20)19-14-5-3-2-4-12(14)9-18/h2-8H,10H2,1H3,(H,19,20)
InChIKeySBICEWHKXGXUEX-UHFFFAOYSA-N
MW284.29 g/mol
LogP3.02
Rot. Bonds4

About N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide

N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide (PubChem CID 64854041) has the molecular formula C16H13FN2O2 and a molecular weight of 284.29 g/mol. Its IUPAC name is N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide
PubChem CID64854041
Molecular FormulaC16H13FN2O2
Molecular Weight284.29 g/mol
Exact Mass284.10
IUPAC NameN-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide
SMILESCc1ccc(F)c(OCC(=O)Nc2ccccc2C#N)c1
InChIInChI=1S/C16H13FN2O2/c1-11-6-7-13(17)15(8-11)21-10-16(20)19-14-5-3-2-4-12(14)9-18/h2-8H,10H2,1H3,(H,19,20)
InChIKeySBICEWHKXGXUEX-UHFFFAOYSA-N
XLogP3.02
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.29
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide 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

2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide
CID 115918411
N-(2-cyanophenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 876328
N-(2-cyanophenyl)-2-(2,4,5-trichlorophenoxy)acetamide
CID 4511857
N-(2-cyanophenyl)-2-(2-methoxyphenoxy)acetamide
CID 922260
N-(2-cyanophenyl)-3-(2,5-dimethylphenoxy)propanamide
CID 43824298
2-(2,5-dimethylphenoxy)-N-[2-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]acetamide
CID 1012654
N-(5-amino-2-fluorophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide
CID 64853622
N-(2-fluoro-4-methylphenyl)-2-(2-fluorophenoxy)acetamide
CID 7815061
2-(2-chloro-5-methylphenoxy)-N-(2-fluorophenyl)acetamide
CID 7642832
2-(2-cyanophenoxy)-N-(4-fluoro-3-methylphenyl)acetamide
CID 62812512
N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide
CID 26216328
N-(2-cyanoethyl)-2-(2-fluoro-5-methylphenoxy)acetamide
CID 64854138

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide?
The IUPAC name of N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide (CID 64854041) is N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide.
What is the SMILES notation for N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide?
The canonical SMILES for N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide is Cc1ccc(F)c(OCC(=O)Nc2ccccc2C#N)c1.
What is the InChIKey of N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide?
The InChIKey is SBICEWHKXGXUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O2/c1-11-6-7-13(17)15(8-11)21-10-16(20)19-14-5-3-2-4-12(14)9-18/h2-8H,10H2,1H3,(H,19,20).
What are the key properties of N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide?
N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide has a molecular weight of 284.29 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide is sourced from PubChem (CID 64854041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).