4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide

C14H9BrF3NO2 — CID 103926239

IUPAC4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide
SMILESO=C(Nc1cccc(O)c1)c1ccc(Br)cc1C(F)(F)F
InChIInChI=1S/C14H9BrF3NO2/c15-8-4-5-11(12(6-8)14(16,17)18)13(21)19-9-2-1-3-10(20)7-9/h1-7,20H,(H,19,21)
InChIKeyBUJADYPEDFZLKF-UHFFFAOYSA-N
MW360.13 g/mol
LogP4.43
Rot. Bonds2

About 4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide

4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide (PubChem CID 103926239) has the molecular formula C14H9BrF3NO2 and a molecular weight of 360.13 g/mol. Its IUPAC name is 4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide
PubChem CID103926239
Molecular FormulaC14H9BrF3NO2
Molecular Weight360.13 g/mol
Exact Mass358.98
IUPAC Name4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide
SMILESO=C(Nc1cccc(O)c1)c1ccc(Br)cc1C(F)(F)F
InChIInChI=1S/C14H9BrF3NO2/c15-8-4-5-11(12(6-8)14(16,17)18)13(21)19-9-2-1-3-10(20)7-9/h1-7,20H,(H,19,21)
InChIKeyBUJADYPEDFZLKF-UHFFFAOYSA-N
XLogP4.43
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.13
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide
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2-bromo-4-fluoro-N-(3-hydroxyphenyl)benzamide
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N-[3-[[2,4-dibromo-6-(trifluoromethyl)phenyl]carbamoyl]phenyl]-2-(trifluoromethyl)benzamide
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N-(3-methylphenyl)-2-(trifluoromethyl)benzamide
CID 846758
4-bromo-N-(2-iodoethyl)-2-(trifluoromethyl)benzamide
CID 107333591
4-bromo-N-methoxy-2-(trifluoromethyl)benzamide
CID 103925205
4-bromo-N-(4-methyl-3-pyridinyl)-2-(trifluoromethyl)benzamide
CID 103924957
2-amino-N-(3-hydroxyphenyl)benzamide
CID 3596059
N-(3-fluorophenyl)-2-(trifluoromethyl)benzamide
CID 139177364
4-bromo-N-(1,2,4-triazin-3-yl)-2-(trifluoromethyl)benzamide
CID 107332970

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide?
The IUPAC name of 4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide (CID 103926239) is 4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide.
What is the SMILES notation for 4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide?
The canonical SMILES for 4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide is O=C(Nc1cccc(O)c1)c1ccc(Br)cc1C(F)(F)F.
What is the InChIKey of 4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide?
The InChIKey is BUJADYPEDFZLKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9BrF3NO2/c15-8-4-5-11(12(6-8)14(16,17)18)13(21)19-9-2-1-3-10(20)7-9/h1-7,20H,(H,19,21).
What are the key properties of 4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide?
4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide has a molecular weight of 360.13 g/mol, XLogP of 4.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(3-hydroxyphenyl)-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 103926239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).