N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide

C16H13F4NO3 — CID 87000961

IUPACN-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide
SMILESCOc1cc(F)ccc1NC(=O)COc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C16H13F4NO3/c1-23-14-8-11(17)4-7-13(14)21-15(22)9-24-12-5-2-10(3-6-12)16(18,19)20/h2-8H,9H2,1H3,(H,21,22)
InChIKeyKJTLLFDSPUNXAI-UHFFFAOYSA-N
MW343.28 g/mol
LogP3.87
Rot. Bonds5

About N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide

N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide (PubChem CID 87000961) has the molecular formula C16H13F4NO3 and a molecular weight of 343.28 g/mol. Its IUPAC name is N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide
PubChem CID87000961
Molecular FormulaC16H13F4NO3
Molecular Weight343.28 g/mol
Exact Mass343.08
IUPAC NameN-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide
SMILESCOc1cc(F)ccc1NC(=O)COc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C16H13F4NO3/c1-23-14-8-11(17)4-7-13(14)21-15(22)9-24-12-5-2-10(3-6-12)16(18,19)20/h2-8H,9H2,1H3,(H,21,22)
InChIKeyKJTLLFDSPUNXAI-UHFFFAOYSA-N
XLogP3.87
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.28
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]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

N-(5-acetamido-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 8510112
N-(2,4-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 868059
N-(4-fluoro-2-methoxyphenyl)-2-(2-oxochromen-7-yl)oxyacetamide
CID 32607911
N-(4-chloro-2,5-dimethoxyphenyl)-2-(4-fluorophenoxy)acetamide
CID 8501524
N-(4-fluoro-2-methoxyphenyl)-2-(2-phenoxyethoxy)acetamide
CID 86998252
N-(2-fluorophenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 7467631
3-(4-fluoro-2-methoxyanilino)-3-oxopropanoic acid
CID 62232302
N-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 7980515
2,2,2-trifluoro-N-(4-fluoro-2-methoxyphenyl)acetamide
CID 62492319
N-(2,4-difluorophenyl)-2-(4-methylphenoxy)acetamide
CID 755254
N-(4-fluoro-2-methoxyphenyl)-3-sulfanylpropanamide
CID 107025881
N-[2-(2-methoxyphenyl)ethyl]-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 8510041

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide?
The IUPAC name of N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide (CID 87000961) is N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide.
What is the SMILES notation for N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide?
The canonical SMILES for N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide is COc1cc(F)ccc1NC(=O)COc1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide?
The InChIKey is KJTLLFDSPUNXAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F4NO3/c1-23-14-8-11(17)4-7-13(14)21-15(22)9-24-12-5-2-10(3-6-12)16(18,19)20/h2-8H,9H2,1H3,(H,21,22).
What are the key properties of N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide?
N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide has a molecular weight of 343.28 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methoxyphenyl)-2-[4-(trifluoromethyl)phenoxy]acetamide is sourced from PubChem (CID 87000961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).