N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide

C13H8BrF2NO2 — CID 107676284

IUPACN-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide
SMILESO=C(Nc1ccc(F)cc1Br)c1ccc(O)cc1F
InChIInChI=1S/C13H8BrF2NO2/c14-10-5-7(15)1-4-12(10)17-13(19)9-3-2-8(18)6-11(9)16/h1-6,18H,(H,17,19)
InChIKeyLYAZDONZVORVCR-UHFFFAOYSA-N
MW328.11 g/mol
LogP3.69
Rot. Bonds2

About N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide

N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide (PubChem CID 107676284) has the molecular formula C13H8BrF2NO2 and a molecular weight of 328.11 g/mol. Its IUPAC name is N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide
PubChem CID107676284
Molecular FormulaC13H8BrF2NO2
Molecular Weight328.11 g/mol
Exact Mass326.97
IUPAC NameN-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide
SMILESO=C(Nc1ccc(F)cc1Br)c1ccc(O)cc1F
InChIInChI=1S/C13H8BrF2NO2/c14-10-5-7(15)1-4-12(10)17-13(19)9-3-2-8(18)6-11(9)16/h1-6,18H,(H,17,19)
InChIKeyLYAZDONZVORVCR-UHFFFAOYSA-N
XLogP3.69
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.11
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,4-difluorophenyl)-2-fluoro-4-hydroxybenzamide
CID 103941207
N-(2-bromo-4-methylphenyl)-2-fluoro-4-hydroxybenzamide
CID 107676274
N-(2-bromo-4-fluorophenyl)-4-hydroxy-2-methylbenzamide
CID 107671523
5-fluoro-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674704
N-(2-bromo-4-chlorophenyl)-4-chloro-2-fluorobenzamide
CID 81027870
N-(2-chloro-4-hydroxyphenyl)-2,4-difluorobenzamide
CID 64786772
N-(2-bromo-4-fluorophenyl)-4-fluoro-2-methylbenzamide
CID 112702520
4-bromo-N-(2,4-dibromophenyl)-2-fluorobenzamide
CID 26691585
5-bromo-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674832
2-bromo-4-fluoro-N-(4-hydroxy-2-nitrophenyl)benzamide
CID 60954645
4-bromo-2-[(2-fluoro-4-hydroxybenzoyl)amino]benzoic acid
CID 107674764
2-bromo-N-(2,5-difluorophenyl)-4-fluorobenzamide
CID 24710516

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide?
The IUPAC name of N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide (CID 107676284) is N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide.
What is the SMILES notation for N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide?
The canonical SMILES for N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide is O=C(Nc1ccc(F)cc1Br)c1ccc(O)cc1F.
What is the InChIKey of N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide?
The InChIKey is LYAZDONZVORVCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrF2NO2/c14-10-5-7(15)1-4-12(10)17-13(19)9-3-2-8(18)6-11(9)16/h1-6,18H,(H,17,19).
What are the key properties of N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide?
N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide has a molecular weight of 328.11 g/mol, XLogP of 3.69, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-fluorophenyl)-2-fluoro-4-hydroxybenzamide is sourced from PubChem (CID 107676284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).