2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide

C15H10Cl2F3NO — CID 3496119

IUPAC2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide
SMILESO=C(NCc1cccc(C(F)(F)F)c1)c1cccc(Cl)c1Cl
InChIInChI=1S/C15H10Cl2F3NO/c16-12-6-2-5-11(13(12)17)14(22)21-8-9-3-1-4-10(7-9)15(18,19)20/h1-7H,8H2,(H,21,22)
InChIKeyIFHZOGDEYHFNQO-UHFFFAOYSA-N
MW348.15 g/mol
LogP4.94
Rot. Bonds3

About 2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide

2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide (PubChem CID 3496119) has the molecular formula C15H10Cl2F3NO and a molecular weight of 348.15 g/mol. Its IUPAC name is 2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide
PubChem CID3496119
Molecular FormulaC15H10Cl2F3NO
Molecular Weight348.15 g/mol
Exact Mass347.01
IUPAC Name2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide
SMILESO=C(NCc1cccc(C(F)(F)F)c1)c1cccc(Cl)c1Cl
InChIInChI=1S/C15H10Cl2F3NO/c16-12-6-2-5-11(13(12)17)14(22)21-8-9-3-1-4-10(7-9)15(18,19)20/h1-7H,8H2,(H,21,22)
InChIKeyIFHZOGDEYHFNQO-UHFFFAOYSA-N
XLogP4.94
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.15
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide?
The IUPAC name of 2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide (CID 3496119) is 2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide.
What is the SMILES notation for 2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide?
The canonical SMILES for 2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide is O=C(NCc1cccc(C(F)(F)F)c1)c1cccc(Cl)c1Cl.
What is the InChIKey of 2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide?
The InChIKey is IFHZOGDEYHFNQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2F3NO/c16-12-6-2-5-11(13(12)17)14(22)21-8-9-3-1-4-10(7-9)15(18,19)20/h1-7H,8H2,(H,21,22).
What are the key properties of 2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide?
2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide has a molecular weight of 348.15 g/mol, XLogP of 4.94, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N-[[3-(trifluoromethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 3496119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).