N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide

C12H8BrFN2O2 — CID 104929862

IUPACN-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide
SMILESO=C(Nc1ncccc1Br)c1c(O)cccc1F
InChIInChI=1S/C12H8BrFN2O2/c13-7-3-2-6-15-11(7)16-12(18)10-8(14)4-1-5-9(10)17/h1-6,17H,(H,15,16,18)
InChIKeyCGMNMEURPWQMSB-UHFFFAOYSA-N
MW311.11 g/mol
LogP2.94
Rot. Bonds2

About N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide

N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide (PubChem CID 104929862) has the molecular formula C12H8BrFN2O2 and a molecular weight of 311.11 g/mol. Its IUPAC name is N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide.

Molecular Properties

Compound NameN-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide
PubChem CID104929862
Molecular FormulaC12H8BrFN2O2
Molecular Weight311.11 g/mol
Exact Mass309.98
IUPAC NameN-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide
SMILESO=C(Nc1ncccc1Br)c1c(O)cccc1F
InChIInChI=1S/C12H8BrFN2O2/c13-7-3-2-6-15-11(7)16-12(18)10-8(14)4-1-5-9(10)17/h1-6,17H,(H,15,16,18)
InChIKeyCGMNMEURPWQMSB-UHFFFAOYSA-N
XLogP2.94
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.11
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-amino-3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide
CID 107013249
2-fluoro-6-hydroxy-N-(2-methyl-3-pyridinyl)benzamide
CID 104917973
N-(2-bromo-6-hydroxyphenyl)-2,6-difluorobenzamide
CID 135066630
N-(3-bromo-2-pyridinyl)-2,4-difluoro-5-methylbenzamide
CID 112696541
2-bromo-6-fluoro-N-pyridin-4-ylbenzamide
CID 59618072
N-(2-bromo-4-chlorophenyl)-2-fluoro-6-hydroxybenzamide
CID 107015030
2-bromo-6-hydroxy-N-quinolin-8-ylbenzamide
CID 174610823
N-(3-bromo-2-pyridinyl)-2-methylsulfanylbenzamide
CID 79214209
3-bromo-N-(3-chloro-2-pyridinyl)-2-fluorobenzamide
CID 106547626
2-amino-N-(3-bromo-2-pyridinyl)-3-chlorobenzamide
CID 115540802
N-(2,6-dichlorophenyl)-2-fluoro-6-hydroxybenzamide
CID 107015267
2-bromo-6-fluoro-N-(6-fluoro-3-pyridinyl)benzamide
CID 113262877

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide?
The IUPAC name of N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide (CID 104929862) is N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide.
What is the SMILES notation for N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide?
The canonical SMILES for N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide is O=C(Nc1ncccc1Br)c1c(O)cccc1F.
What is the InChIKey of N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide?
The InChIKey is CGMNMEURPWQMSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrFN2O2/c13-7-3-2-6-15-11(7)16-12(18)10-8(14)4-1-5-9(10)17/h1-6,17H,(H,15,16,18).
What are the key properties of N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide?
N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide has a molecular weight of 311.11 g/mol, XLogP of 2.94, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-2-pyridinyl)-2-fluoro-6-hydroxybenzamide is sourced from PubChem (CID 104929862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).