N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide

C84H60Br4Cl2F8I4N6O12 — CID 167585391

About N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide

N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide (PubChem CID 167585391) has the molecular formula C84H60Br4Cl2F8I4N6O12 and a molecular weight of 2395.56 g/mol. Its IUPAC name is N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide.

Molecular Properties

• Compound Name: N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide
• PubChem CID: 167585391
• Molecular Formula: C84H60Br4Cl2F8I4N6O12
• Molecular Weight: 2395.56 g/mol
• Exact Mass: 2389.64
• IUPAC Name: N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide
• SMILES: Cc1cc(C)cc(NC(=O)c2cc(Br)ccc2O)c1.Cc1cc(C)cc(NC(=O)c2cc(I)ccc2O)c1.O=C(Nc1cc(Br)cc(Br)c1)c1cc(I)ccc1O.O=C(Nc1cc(C(F)(F)F)ccc1C(F)(F)F)c1cc(Br)ccc1O.O=C(Nc1cc(Cl)cc(Cl)c1)c1cc(I)ccc1O.O=C(Nc1cc(F)cc(F)c1)c1cc(I)ccc1O
• InChI: InChI=1S/C15H8BrF6NO2.C15H14BrNO2.C15H14INO2.C13H8Br2INO2.C13H8Cl2INO2.C13H8F2INO2/c16-8-2-4-12(24)9(6-8)13(25)23-11-5-7(14(17,18)19)1-3-10(11)15(20,21)22;2*1-9-5-10(2)7-12(6-9)17-15(19)13-8-11(16)3-4-14(13)18;3*14-7-3-8(15)5-10(4-7)17-13(19)11-6-9(16)1-2-12(11)18/h1-6,24H,(H,23,25);2*3-8,18H,1-2H3,(H,17,19);3*1-6,18H,(H,17,19)
• InChIKey: HSQISZWQNMCWJE-UHFFFAOYSA-N
• XLogP: 26.19
• TPSA: 295.98 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 12
• Rotatable Bonds: 12
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2395.56
LogP ≤ 5	26.19
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'iodine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide?

The IUPAC name of N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide (CID 167585391) is N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide.

What is the SMILES notation for N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide?

The canonical SMILES for N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide is Cc1cc(C)cc(NC(=O)c2cc(Br)ccc2O)c1.Cc1cc(C)cc(NC(=O)c2cc(I)ccc2O)c1.O=C(Nc1cc(Br)cc(Br)c1)c1cc(I)ccc1O.O=C(Nc1cc(C(F)(F)F)ccc1C(F)(F)F)c1cc(Br)ccc1O.O=C(Nc1cc(Cl)cc(Cl)c1)c1cc(I)ccc1O.O=C(Nc1cc(F)cc(F)c1)c1cc(I)ccc1O.

What is the InChIKey of N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide?

The InChIKey is HSQISZWQNMCWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8BrF6NO2.C15H14BrNO2.C15H14INO2.C13H8Br2INO2.C13H8Cl2INO2.C13H8F2INO2/c16-8-2-4-12(24)9(6-8)13(25)23-11-5-7(14(17,18)19)1-3-10(11)15(20,21)22;2*1-9-5-10(2)7-12(6-9)17-15(19)13-8-11(16)3-4-14(13)18;3*14-7-3-8(15)5-10(4-7)17-13(19)11-6-9(16)1-2-12(11)18/h1-6,24H,(H,23,25);2*3-8,18H,1-2H3,(H,17,19);3*1-6,18H,(H,17,19).

What are the key properties of N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide?

N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide has a molecular weight of 2395.56 g/mol, XLogP of 26.19, 12 rotatable bonds, 12 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide is sourced from PubChem (CID 167585391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).