5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide

C17H14ClF3N2O3 — CID 38262201

IUPAC5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide
SMILESC[C@H](Oc1ccc(Cl)cc1C(N)=O)C(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C17H14ClF3N2O3/c1-9(26-14-7-6-10(18)8-11(14)15(22)24)16(25)23-13-5-3-2-4-12(13)17(19,20)21/h2-9H,1H3,(H2,22,24)(H,23,25)/t9-/m0/s1
InChIKeyQRVMQTIFPCYWST-VIFPVBQESA-N
MW386.76 g/mol
LogP3.86
Rot. Bonds5

About 5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide

5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide (PubChem CID 38262201) has the molecular formula C17H14ClF3N2O3 and a molecular weight of 386.76 g/mol. Its IUPAC name is 5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide.

Molecular Properties

Compound Name5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide
PubChem CID38262201
Molecular FormulaC17H14ClF3N2O3
Molecular Weight386.76 g/mol
Exact Mass386.06
IUPAC Name5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide
SMILESC[C@H](Oc1ccc(Cl)cc1C(N)=O)C(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C17H14ClF3N2O3/c1-9(26-14-7-6-10(18)8-11(14)15(22)24)16(25)23-13-5-3-2-4-12(13)17(19,20)21/h2-9H,1H3,(H2,22,24)(H,23,25)/t9-/m0/s1
InChIKeyQRVMQTIFPCYWST-VIFPVBQESA-N
XLogP3.86
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.76
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide 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

(2S)-2-(2,4-dichlorophenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 7720105
2-[2-(2,4-dichlorophenoxy)propanoylamino]benzamide
CID 3579546
2-[[(2S)-2-(2,4-dichlorophenoxy)propanoyl]amino]benzamide
CID 1335501
2-[[(2R)-2-(2-bromo-4-chlorophenoxy)propanoyl]amino]benzamide
CID 40771324
5-chloro-2-[(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl]oxybenzamide
CID 9362462
2-(2,3-dichlorophenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 46633814
5-chloro-2-[1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl]oxybenzamide
CID 51263861
2-(2,4-dibromophenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 55418069
(2S)-N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(2,4-dimethylphenoxy)propanamide
CID 1019961
2-(3,4-dichlorophenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 13052546
2-(2-bromo-4-methylphenoxy)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 46633931
(2R)-2-(2,4-dichlorophenoxy)-N-(2-fluorophenyl)propanamide
CID 881150

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide?
The IUPAC name of 5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide (CID 38262201) is 5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide.
What is the SMILES notation for 5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide?
The canonical SMILES for 5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide is C[C@H](Oc1ccc(Cl)cc1C(N)=O)C(=O)Nc1ccccc1C(F)(F)F.
What is the InChIKey of 5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide?
The InChIKey is QRVMQTIFPCYWST-VIFPVBQESA-N. The full InChI is InChI=1S/C17H14ClF3N2O3/c1-9(26-14-7-6-10(18)8-11(14)15(22)24)16(25)23-13-5-3-2-4-12(13)17(19,20)21/h2-9H,1H3,(H2,22,24)(H,23,25)/t9-/m0/s1.
What are the key properties of 5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide?
5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide has a molecular weight of 386.76 g/mol, XLogP of 3.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[(2S)-1-oxo-1-[2-(trifluoromethyl)anilino]propan-2-yl]oxybenzamide is sourced from PubChem (CID 38262201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).