N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide

C15H11F4NO — CID 26522930

IUPACN-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide
SMILESCc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)c(F)c1
InChIInChI=1S/C15H11F4NO/c1-9-5-6-13(12(16)7-9)20-14(21)10-3-2-4-11(8-10)15(17,18)19/h2-8H,1H3,(H,20,21)
InChIKeyKCDNTSKVVMJEHF-UHFFFAOYSA-N
MW297.25 g/mol
LogP4.41
Rot. Bonds2

About N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide

N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide (PubChem CID 26522930) has the molecular formula C15H11F4NO and a molecular weight of 297.25 g/mol. Its IUPAC name is N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide
PubChem CID26522930
Molecular FormulaC15H11F4NO
Molecular Weight297.25 g/mol
Exact Mass297.08
IUPAC NameN-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide
SMILESCc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)c(F)c1
InChIInChI=1S/C15H11F4NO/c1-9-5-6-13(12(16)7-9)20-14(21)10-3-2-4-11(8-10)15(17,18)19/h2-8H,1H3,(H,20,21)
InChIKeyKCDNTSKVVMJEHF-UHFFFAOYSA-N
XLogP4.41
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.25
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide 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

3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide
CID 26522946
N-(2,3-dimethylphenyl)-3-(trifluoromethyl)benzamide
CID 850563
N-(2-fluoro-4-iodophenyl)-3-methylbenzamide
CID 17102075
4-fluoro-N-(2-fluoro-4-methylphenyl)-3-methylbenzamide
CID 55163065
3-(ethylsulfamoyl)-N-(2-fluoro-4-methylphenyl)benzamide
CID 26698365
N-(2-bromophenyl)-3-(trifluoromethyl)benzamide
CID 2561322
N-(2-chloro-5-methyl-3-pyridinyl)-3-(trifluoromethyl)benzamide
CID 102979678
3-(2,5-dioxopyrrolidin-1-yl)-N-(2-fluoro-4-methylphenyl)benzamide
CID 18166253
N-[3-fluoro-4-(trifluoromethylsulfonylamino)phenyl]-3-(trifluoromethyl)benzamide
CID 155550237
N-[4-(ethylsulfonylamino)-3-fluorophenyl]-3-(trifluoromethyl)benzamide
CID 155545113
3-[(2-fluoro-5-methylphenyl)carbamoyl]benzoic acid
CID 43452946
N-(2-propan-2-ylphenyl)-3-(trifluoromethyl)benzamide
CID 2678500

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide?
The IUPAC name of N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide (CID 26522930) is N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide?
The canonical SMILES for N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide is Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)c(F)c1.
What is the InChIKey of N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide?
The InChIKey is KCDNTSKVVMJEHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F4NO/c1-9-5-6-13(12(16)7-9)20-14(21)10-3-2-4-11(8-10)15(17,18)19/h2-8H,1H3,(H,20,21).
What are the key properties of N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide?
N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide has a molecular weight of 297.25 g/mol, XLogP of 4.41, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-4-methylphenyl)-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 26522930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).