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

C14H8BrClF3NO2 — CID 134146320

IUPAC5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Br)c(Cl)cc1O
InChIInChI=1S/C14H8BrClF3NO2/c15-10-5-9(12(21)6-11(10)16)13(22)20-8-3-1-7(2-4-8)14(17,18)19/h1-6,21H,(H,20,22)
InChIKeyUYXDYCKHYRNAOV-UHFFFAOYSA-N
MW394.57 g/mol
LogP5.08
Rot. Bonds2

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

5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide (PubChem CID 134146320) has the molecular formula C14H8BrClF3NO2 and a molecular weight of 394.57 g/mol. Its IUPAC name is 5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
PubChem CID134146320
Molecular FormulaC14H8BrClF3NO2
Molecular Weight394.57 g/mol
Exact Mass392.94
IUPAC Name5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Br)c(Cl)cc1O
InChIInChI=1S/C14H8BrClF3NO2/c15-10-5-9(12(21)6-11(10)16)13(22)20-8-3-1-7(2-4-8)14(17,18)19/h1-6,21H,(H,20,22)
InChIKeyUYXDYCKHYRNAOV-UHFFFAOYSA-N
XLogP5.08
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.57
LogP ≤ 55.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
CID 134151897
4-bromo-3-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 81295641
2-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2064029
N-[2-bromo-5-(trifluoromethyl)phenyl]-5-chloro-2-hydroxybenzamide
CID 71381236
N-[3-bromo-5-(trifluoromethyl)phenyl]-5-chloro-2-hydroxybenzamide
CID 71381238
2-hydroxy-1-N,3-N-bis[4-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide
CID 155920070
3-acetyl-4-chloro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 147118620
N-(3,5-dibromo-4-hydroxyphenyl)-4-(trifluoromethyl)benzamide
CID 25222880
2,5-dimethyl-N-[4-(trifluoromethyl)phenyl]benzamide
CID 7777818
N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide
CID 167685587
2-chloro-4-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2988054
5-chloro-2-nitro-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2684275

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide (CID 134146320) is 5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide is O=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Br)c(Cl)cc1O.
What is the InChIKey of 5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide?
The InChIKey is UYXDYCKHYRNAOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8BrClF3NO2/c15-10-5-9(12(21)6-11(10)16)13(22)20-8-3-1-7(2-4-8)14(17,18)19/h1-6,21H,(H,20,22).
What are the key properties of 5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide?
5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide has a molecular weight of 394.57 g/mol, XLogP of 5.08, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 134146320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).