N-(4-methylphenyl)-4-(trifluoromethyl)benzamide

C15H12F3NO — CID 599447

IUPACN-(4-methylphenyl)-4-(trifluoromethyl)benzamide
SMILESCc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C15H12F3NO/c1-10-2-8-13(9-3-10)19-14(20)11-4-6-12(7-5-11)15(16,17)18/h2-9H,1H3,(H,19,20)
InChIKeyCASABFMVXICIJN-UHFFFAOYSA-N
MW279.26 g/mol
LogP4.27
Rot. Bonds2

About N-(4-methylphenyl)-4-(trifluoromethyl)benzamide

N-(4-methylphenyl)-4-(trifluoromethyl)benzamide (PubChem CID 599447) has the molecular formula C15H12F3NO and a molecular weight of 279.26 g/mol. Its IUPAC name is N-(4-methylphenyl)-4-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-4-(trifluoromethyl)benzamide
PubChem CID599447
Molecular FormulaC15H12F3NO
Molecular Weight279.26 g/mol
Exact Mass279.09
IUPAC NameN-(4-methylphenyl)-4-(trifluoromethyl)benzamide
SMILESCc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C15H12F3NO/c1-10-2-8-13(9-3-10)19-14(20)11-4-6-12(7-5-11)15(16,17)18/h2-9H,1H3,(H,19,20)
InChIKeyCASABFMVXICIJN-UHFFFAOYSA-N
XLogP4.27
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.26
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-methyl-N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]benzamide
CID 770701
N-(4-methylphenyl)-6-[4-(trifluoromethyl)anilino]pyridine-3-carboxamide
CID 109162294
N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide
CID 2223178
N-(4-methylphenyl)-4-[2-[4-[(4-methylphenyl)carbamoyl]phenyl]hydrazinyl]benzamide
CID 139337158
4-methyl-N-[5-(trifluoromethyl)-3-pyridinyl]benzamide
CID 174184894
4-(hydroxymethyl)-N-[4-(trifluoromethyl)phenyl]benzamide
CID 4880235
2,5-dimethyl-N-[4-(trifluoromethyl)phenyl]benzamide
CID 7777818
6-[(4-methylphenyl)methylamino]-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109156003
ethyl 2,2-difluoro-2-[4-[[4-(trifluoromethyl)benzoyl]amino]phenyl]acetate
CID 142688452
4-cyano-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2684239
N-[4-(2-methoxyethylamino)phenyl]-4-(trifluoromethyl)benzamide
CID 112980946
N-[[4-[(4-tert-butylbenzoyl)amino]phenyl]carbamoyl]-4-methylbenzamide
CID 163690008

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-4-(trifluoromethyl)benzamide?
The IUPAC name of N-(4-methylphenyl)-4-(trifluoromethyl)benzamide (CID 599447) is N-(4-methylphenyl)-4-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(4-methylphenyl)-4-(trifluoromethyl)benzamide?
The canonical SMILES for N-(4-methylphenyl)-4-(trifluoromethyl)benzamide is Cc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2)cc1.
What is the InChIKey of N-(4-methylphenyl)-4-(trifluoromethyl)benzamide?
The InChIKey is CASABFMVXICIJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3NO/c1-10-2-8-13(9-3-10)19-14(20)11-4-6-12(7-5-11)15(16,17)18/h2-9H,1H3,(H,19,20).
What are the key properties of N-(4-methylphenyl)-4-(trifluoromethyl)benzamide?
N-(4-methylphenyl)-4-(trifluoromethyl)benzamide has a molecular weight of 279.26 g/mol, XLogP of 4.27, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-4-(trifluoromethyl)benzamide is sourced from PubChem (CID 599447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).