2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide

C21H16F3NO — CID 2399730

IUPAC2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1cccc(C(F)(F)F)c1)c1ccccc1Cc1ccccc1
InChIInChI=1S/C21H16F3NO/c22-21(23,24)17-10-6-11-18(14-17)25-20(26)19-12-5-4-9-16(19)13-15-7-2-1-3-8-15/h1-12,14H,13H2,(H,25,26)
InChIKeyBSVKBCPQLMCCMS-UHFFFAOYSA-N
MW355.36 g/mol
LogP5.55
Rot. Bonds4

About 2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide

2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide (PubChem CID 2399730) has the molecular formula C21H16F3NO and a molecular weight of 355.36 g/mol. Its IUPAC name is 2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide
PubChem CID2399730
Molecular FormulaC21H16F3NO
Molecular Weight355.36 g/mol
Exact Mass355.12
IUPAC Name2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1cccc(C(F)(F)F)c1)c1ccccc1Cc1ccccc1
InChIInChI=1S/C21H16F3NO/c22-21(23,24)17-10-6-11-18(14-17)25-20(26)19-12-5-4-9-16(19)13-15-7-2-1-3-8-15/h1-12,14H,13H2,(H,25,26)
InChIKeyBSVKBCPQLMCCMS-UHFFFAOYSA-N
XLogP5.55
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.36
LogP ≤ 55.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-benzyl-N-[3-(trifluoromethyl)phenyl]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

2-benzyl-N-[3-(hydroxymethyl)phenyl]benzamide
CID 110877152
2-(2-phenylmethoxyphenyl)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 118043131
2-[[(2-methoxybenzoyl)amino]methyl]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 90012211
1-N-benzyl-4-N-[3-(trifluoromethyl)phenyl]benzene-1,4-dicarboxamide
CID 109046746
[2-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl] hypobromite
CID 150746432
2-[[2-methyl-3-(methylamino)propanoyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide;hydrochloride
CID 119752461
2,3,4,5-tetrafluoro-N-[3-(trifluoromethyl)phenyl]benzamide
CID 4542565
2-chloro-N-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]benzamide
CID 3609395
2-hydroxy-4-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 154341283
2-(2-methoxyethoxy)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 56593348
4-[2-[[3-(trifluoromethyl)phenyl]carbamoyl]phenoxy]butanoic acid
CID 134086672
benzyl N-[3-(trifluoromethyl)phenyl]carbamate
CID 5201332

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide (CID 2399730) is 2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide is O=C(Nc1cccc(C(F)(F)F)c1)c1ccccc1Cc1ccccc1.
What is the InChIKey of 2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide?
The InChIKey is BSVKBCPQLMCCMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16F3NO/c22-21(23,24)17-10-6-11-18(14-17)25-20(26)19-12-5-4-9-16(19)13-15-7-2-1-3-8-15/h1-12,14H,13H2,(H,25,26).
What are the key properties of 2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide?
2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide has a molecular weight of 355.36 g/mol, XLogP of 5.55, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-N-[3-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 2399730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).