N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide

C12H8BrFN2O — CID 28938574

IUPACN-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide
SMILESO=C(Nc1ccc(F)cc1Br)c1ccncc1
InChIInChI=1S/C12H8BrFN2O/c13-10-7-9(14)1-2-11(10)16-12(17)8-3-5-15-6-4-8/h1-7H,(H,16,17)
InChIKeyUJFODCDLBSSTNI-UHFFFAOYSA-N
MW295.11 g/mol
LogP3.24
Rot. Bonds2

About N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide

N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide (PubChem CID 28938574) has the molecular formula C12H8BrFN2O and a molecular weight of 295.11 g/mol. Its IUPAC name is N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide
PubChem CID28938574
Molecular FormulaC12H8BrFN2O
Molecular Weight295.11 g/mol
Exact Mass293.98
IUPAC NameN-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide
SMILESO=C(Nc1ccc(F)cc1Br)c1ccncc1
InChIInChI=1S/C12H8BrFN2O/c13-10-7-9(14)1-2-11(10)16-12(17)8-3-5-15-6-4-8/h1-7H,(H,16,17)
InChIKeyUJFODCDLBSSTNI-UHFFFAOYSA-N
XLogP3.24
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.11
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-4-fluorophenyl)-4-fluorobenzamide
CID 28938573
N-(2-amino-4-fluorophenyl)pyridine-4-carboxamide
CID 16772506
N-(2-bromo-4-fluorophenyl)-5-hydroxypyridine-3-carboxamide
CID 55257449
N-(2-bromo-4-fluorophenyl)-2-(methylamino)pyridine-4-carboxamide
CID 62165424
N-(2-bromo-4-fluorophenyl)-3,5-dichlorobenzamide
CID 28938547
4-bromo-N-(2-bromo-4-fluorophenyl)-3-fluorobenzamide
CID 47421840
N-(2-bromophenyl)pyridine-4-carboxamide
CID 882176
N-(2-bromo-4-fluorophenyl)furan-3-carboxamide
CID 28938638
N-(5-bromo-2-fluorophenyl)pyridine-4-carboxamide
CID 110779492
N-(2-bromo-4-fluorophenyl)-5-methylfuran-3-carboxamide
CID 114820853
4-amino-N-(2-bromo-4-fluorophenyl)-3-methylbenzamide
CID 28938520
N-(2-bromo-4-fluorophenyl)-3-methyl-4-(methylamino)benzamide
CID 63210074

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide?
The IUPAC name of N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide (CID 28938574) is N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide?
The canonical SMILES for N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide is O=C(Nc1ccc(F)cc1Br)c1ccncc1.
What is the InChIKey of N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide?
The InChIKey is UJFODCDLBSSTNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrFN2O/c13-10-7-9(14)1-2-11(10)16-12(17)8-3-5-15-6-4-8/h1-7H,(H,16,17).
What are the key properties of N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide?
N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide has a molecular weight of 295.11 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-fluorophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 28938574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).