5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide

C15H11ClF3NO2 — CID 2684084

IUPAC5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide
SMILESCOc1ccc(Cl)cc1C(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H11ClF3NO2/c1-22-13-7-4-10(16)8-12(13)14(21)20-11-5-2-9(3-6-11)15(17,18)19/h2-8H,1H3,(H,20,21)
InChIKeyFTRIQNZCTUFFPI-UHFFFAOYSA-N
MW329.71 g/mol
LogP4.62
Rot. Bonds3

About 5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide

5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide (PubChem CID 2684084) has the molecular formula C15H11ClF3NO2 and a molecular weight of 329.71 g/mol. Its IUPAC name is 5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide
PubChem CID2684084
Molecular FormulaC15H11ClF3NO2
Molecular Weight329.71 g/mol
Exact Mass329.04
IUPAC Name5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide
SMILESCOc1ccc(Cl)cc1C(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C15H11ClF3NO2/c1-22-13-7-4-10(16)8-12(13)14(21)20-11-5-2-9(3-6-11)15(17,18)19/h2-8H,1H3,(H,20,21)
InChIKeyFTRIQNZCTUFFPI-UHFFFAOYSA-N
XLogP4.62
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.71
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-chloro-2-methoxy-N-[4-(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

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide (CID 2684084) is 5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide is COc1ccc(Cl)cc1C(=O)Nc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide?
The InChIKey is FTRIQNZCTUFFPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClF3NO2/c1-22-13-7-4-10(16)8-12(13)14(21)20-11-5-2-9(3-6-11)15(17,18)19/h2-8H,1H3,(H,20,21).
What are the key properties of 5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide?
5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide has a molecular weight of 329.71 g/mol, XLogP of 4.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methoxy-N-[4-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 2684084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).