N-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide

C13H8BrF2NO2 — CID 43132174

IUPACN-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide
SMILESO=C(Nc1c(F)cc(F)cc1Br)c1cccc(O)c1
InChIInChI=1S/C13H8BrF2NO2/c14-10-5-8(15)6-11(16)12(10)17-13(19)7-2-1-3-9(18)4-7/h1-6,18H,(H,17,19)
InChIKeyZZFCCVLEXFXFDR-UHFFFAOYSA-N
MW328.11 g/mol
LogP3.69
Rot. Bonds2

About N-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide

N-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide (PubChem CID 43132174) has the molecular formula C13H8BrF2NO2 and a molecular weight of 328.11 g/mol. Its IUPAC name is N-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide
PubChem CID43132174
Molecular FormulaC13H8BrF2NO2
Molecular Weight328.11 g/mol
Exact Mass326.97
IUPAC NameN-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide
SMILESO=C(Nc1c(F)cc(F)cc1Br)c1cccc(O)c1
InChIInChI=1S/C13H8BrF2NO2/c14-10-5-8(15)6-11(16)12(10)17-13(19)7-2-1-3-9(18)4-7/h1-6,18H,(H,17,19)
InChIKeyZZFCCVLEXFXFDR-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-bromo-4,6-difluorophenyl)-3-cyanobenzamide
CID 43090996
3-bromo-N-(2-bromo-4,6-difluorophenyl)-4-methylbenzamide
CID 81471642
N-(2-bromo-4,6-difluorophenyl)-4-(bromomethyl)benzamide
CID 102850915
N-(2-bromo-4,6-difluorophenyl)-2-chloropyridine-4-carboxamide
CID 43237002
N-(2-bromo-4,6-difluorophenyl)-2-hydroxy-3-methylbenzamide
CID 43244596
3-bromo-N-(2-chloro-4,6-difluorophenyl)benzamide
CID 82889682
N-(2-bromo-4,6-difluorophenyl)furan-2-carboxamide
CID 1244098
3-hydroxy-N-(3,4,5-trifluorophenyl)benzamide
CID 55118892
(2-bromo-4,6-difluorophenyl)urea
CID 43347715
N-(3-chloro-5-fluorophenyl)-3-hydroxybenzamide
CID 107366818
3-amino-N-(2-bromo-4,6-difluorophenyl)-5-fluoro-4-methylbenzamide
CID 60862529
3-bromo-4-chloro-N-(2-chloro-4,6-difluorophenyl)benzamide
CID 103878381

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide?
The IUPAC name of N-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide (CID 43132174) is N-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide.
What is the SMILES notation for N-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide?
The canonical SMILES for N-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide is O=C(Nc1c(F)cc(F)cc1Br)c1cccc(O)c1.
What is the InChIKey of N-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide?
The InChIKey is ZZFCCVLEXFXFDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrF2NO2/c14-10-5-8(15)6-11(16)12(10)17-13(19)7-2-1-3-9(18)4-7/h1-6,18H,(H,17,19).
What are the key properties of N-(2-bromo-4,6-difluorophenyl)-3-hydroxybenzamide?
N-(2-bromo-4,6-difluorophenyl)-3-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-4,6-difluorophenyl)-3-hydroxybenzamide is sourced from PubChem (CID 43132174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).