N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide

C22H17F3N2O3 — CID 55797164

IUPACN-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide
SMILESO=C(Cc1ccc(OC(F)(F)F)cc1)Nc1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C22H17F3N2O3/c23-22(24,25)30-19-11-9-15(10-12-19)13-20(28)26-17-7-4-8-18(14-17)27-21(29)16-5-2-1-3-6-16/h1-12,14H,13H2,(H,26,28)(H,27,29)
InChIKeyWKACWQWGQSLDDA-UHFFFAOYSA-N
MW414.38 g/mol
LogP5.02
Rot. Bonds6

About N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide

N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide (PubChem CID 55797164) has the molecular formula C22H17F3N2O3 and a molecular weight of 414.38 g/mol. Its IUPAC name is N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide.

Molecular Properties

Compound NameN-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide
PubChem CID55797164
Molecular FormulaC22H17F3N2O3
Molecular Weight414.38 g/mol
Exact Mass414.12
IUPAC NameN-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide
SMILESO=C(Cc1ccc(OC(F)(F)F)cc1)Nc1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C22H17F3N2O3/c23-22(24,25)30-19-11-9-15(10-12-19)13-20(28)26-17-7-4-8-18(14-17)27-21(29)16-5-2-1-3-6-16/h1-12,14H,13H2,(H,26,28)(H,27,29)
InChIKeyWKACWQWGQSLDDA-UHFFFAOYSA-N
XLogP5.02
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.38
LogP ≤ 55.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]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

3-[[4-(trifluoromethoxy)benzoyl]amino]benzoic acid;hydrochloride
CID 67278377
methyl 3-[[4-(trifluoromethoxy)benzoyl]amino]benzoate
CID 4963798
4-(aminomethyl)-N-[3-(trifluoromethoxy)phenyl]benzamide;hydrochloride
CID 171320799
4-(aminomethyl)-N-[3-(trifluoromethoxy)phenyl]benzamide;dihydrochloride
CID 165436568
2-naphthalen-2-yl-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 18277342
3-(2-phenoxyethoxy)-N-[3-[(2-phenylacetyl)amino]phenyl]benzamide
CID 17235625
4-(phenoxymethyl)-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 7957132
N-(3-benzamidophenyl)-4-ethylbenzamide
CID 17102471
3-bromo-N-[3-[(2-phenylacetyl)amino]phenyl]benzamide
CID 54790995
N-(3-acetamidophenyl)-4-[(2-phenylacetyl)amino]benzamide
CID 17119477
2-(4-chlorophenyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2678277
N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 46484833

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide?
The IUPAC name of N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide (CID 55797164) is N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide.
What is the SMILES notation for N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide?
The canonical SMILES for N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide is O=C(Cc1ccc(OC(F)(F)F)cc1)Nc1cccc(NC(=O)c2ccccc2)c1.
What is the InChIKey of N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide?
The InChIKey is WKACWQWGQSLDDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17F3N2O3/c23-22(24,25)30-19-11-9-15(10-12-19)13-20(28)26-17-7-4-8-18(14-17)27-21(29)16-5-2-1-3-6-16/h1-12,14H,13H2,(H,26,28)(H,27,29).
What are the key properties of N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide?
N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide has a molecular weight of 414.38 g/mol, XLogP of 5.02, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]benzamide is sourced from PubChem (CID 55797164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).