5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide

C91H69BrCl3F19N6O11 — CID 167673373

IUPAC5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide
SMILESCOc1ccc(Cl)cc1C(=O)Nc1cc(C)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cc(Br)ccc2O)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cc(F)ccc2O)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cccc(Cl)c2)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cccc(Cl)c2O)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2ccccc2O)cc(C(F)(F)F)c1
InChIInChI=1S/C16H13ClF3NO2.C15H11BrF3NO2.C15H11ClF3NO2.C15H11ClF3NO.C15H11F4NO2.C15H12F3NO2/c1-9-5-10(16(18,19)20)7-12(6-9)21-15(22)13-8-11(17)3-4-14(13)23-2;1-8-4-9(15(17,18)19)6-11(5-8)20-14(22)12-7-10(16)2-3-13(12)21;1-8-5-9(15(17,18)19)7-10(6-8)20-14(22)11-3-2-4-12(16)13(11)21;1-9-5-11(15(17,18)19)8-13(6-9)20-14(21)10-3-2-4-12(16)7-10;1-8-4-9(15(17,18)19)6-11(5-8)20-14(22)12-7-10(16)2-3-13(12)21;1-9-6-10(15(16,17)18)8-11(7-9)19-14(21)12-4-2-3-5-13(12)20/h3-8H,1-2H3,(H,21,22);2*2-7,21H,1H3,(H,20,22);2-8H,1H3,(H,20,21);2-7,21H,1H3,(H,20,22);2-8,20H,1H3,(H,19,21)
InChIKeyULMQSXGXJUMLDP-UHFFFAOYSA-N
MW1969.81 g/mol
LogP27.29
Rot. Bonds13

About 5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide

5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide (PubChem CID 167673373) has the molecular formula C91H69BrCl3F19N6O11 and a molecular weight of 1969.81 g/mol. Its IUPAC name is 5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide
PubChem CID167673373
Molecular FormulaC91H69BrCl3F19N6O11
Molecular Weight1969.81 g/mol
Exact Mass1966.30
IUPAC Name5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide
SMILESCOc1ccc(Cl)cc1C(=O)Nc1cc(C)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cc(Br)ccc2O)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cc(F)ccc2O)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cccc(Cl)c2)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cccc(Cl)c2O)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2ccccc2O)cc(C(F)(F)F)c1
InChIInChI=1S/C16H13ClF3NO2.C15H11BrF3NO2.C15H11ClF3NO2.C15H11ClF3NO.C15H11F4NO2.C15H12F3NO2/c1-9-5-10(16(18,19)20)7-12(6-9)21-15(22)13-8-11(17)3-4-14(13)23-2;1-8-4-9(15(17,18)19)6-11(5-8)20-14(22)12-7-10(16)2-3-13(12)21;1-8-5-9(15(17,18)19)7-10(6-8)20-14(22)11-3-2-4-12(16)13(11)21;1-9-5-11(15(17,18)19)8-13(6-9)20-14(21)10-3-2-4-12(16)7-10;1-8-4-9(15(17,18)19)6-11(5-8)20-14(22)12-7-10(16)2-3-13(12)21;1-9-6-10(15(16,17)18)8-11(7-9)19-14(21)12-4-2-3-5-13(12)20/h3-8H,1-2H3,(H,21,22);2*2-7,21H,1H3,(H,20,22);2-8H,1H3,(H,20,21);2-7,21H,1H3,(H,20,22);2-8,20H,1H3,(H,19,21)
InChIKeyULMQSXGXJUMLDP-UHFFFAOYSA-N
XLogP27.29
TPSA264.75 Ų
H-Bond Donors10
H-Bond Acceptors11
Rotatable Bonds13
Heavy Atoms131
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001969.81
LogP ≤ 527.29
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1011

Analyze 5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide (CID 167673373) is 5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide is COc1ccc(Cl)cc1C(=O)Nc1cc(C)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cc(Br)ccc2O)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cc(F)ccc2O)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cccc(Cl)c2)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2cccc(Cl)c2O)cc(C(F)(F)F)c1.Cc1cc(NC(=O)c2ccccc2O)cc(C(F)(F)F)c1.
What is the InChIKey of 5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide?
The InChIKey is ULMQSXGXJUMLDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClF3NO2.C15H11BrF3NO2.C15H11ClF3NO2.C15H11ClF3NO.C15H11F4NO2.C15H12F3NO2/c1-9-5-10(16(18,19)20)7-12(6-9)21-15(22)13-8-11(17)3-4-14(13)23-2;1-8-4-9(15(17,18)19)6-11(5-8)20-14(22)12-7-10(16)2-3-13(12)21;1-8-5-9(15(17,18)19)7-10(6-8)20-14(22)11-3-2-4-12(16)13(11)21;1-9-5-11(15(17,18)19)8-13(6-9)20-14(21)10-3-2-4-12(16)7-10;1-8-4-9(15(17,18)19)6-11(5-8)20-14(22)12-7-10(16)2-3-13(12)21;1-9-6-10(15(16,17)18)8-11(7-9)19-14(21)12-4-2-3-5-13(12)20/h3-8H,1-2H3,(H,21,22);2*2-7,21H,1H3,(H,20,22);2-8H,1H3,(H,20,21);2-7,21H,1H3,(H,20,22);2-8,20H,1H3,(H,19,21).
What are the key properties of 5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide?
5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide has a molecular weight of 1969.81 g/mol, XLogP of 27.29, 13 rotatable bonds, 10 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-chloro-2-methoxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;3-chloro-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;5-fluoro-2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide;2-hydroxy-N-[3-methyl-5-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 167673373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).