5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide

C12H7BrClFN2O — CID 113259351

IUPAC5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1cc(F)cc(Cl)c1)c1ccc(Br)cn1
InChIInChI=1S/C12H7BrClFN2O/c13-7-1-2-11(16-6-7)12(18)17-10-4-8(14)3-9(15)5-10/h1-6H,(H,17,18)
InChIKeyHVOQNBSXSMQLCV-UHFFFAOYSA-N
MW329.56 g/mol
LogP3.89
Rot. Bonds2

About 5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide

5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide (PubChem CID 113259351) has the molecular formula C12H7BrClFN2O and a molecular weight of 329.56 g/mol. Its IUPAC name is 5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide
PubChem CID113259351
Molecular FormulaC12H7BrClFN2O
Molecular Weight329.56 g/mol
Exact Mass327.94
IUPAC Name5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1cc(F)cc(Cl)c1)c1ccc(Br)cn1
InChIInChI=1S/C12H7BrClFN2O/c13-7-1-2-11(16-6-7)12(18)17-10-4-8(14)3-9(15)5-10/h1-6H,(H,17,18)
InChIKeyHVOQNBSXSMQLCV-UHFFFAOYSA-N
XLogP3.89
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.56
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-N-[3-chloro-5-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 116700198
6-[(3-chloro-5-fluorophenyl)carbamoyl]pyridine-3-carboxylic acid
CID 107370115
5-bromo-N-(3,4,5-trifluorophenyl)pyridine-2-carboxamide
CID 55152694
4-bromo-N-(3-chloro-5-fluorophenyl)-2-fluorobenzamide
CID 103774690
5-bromo-N-(2-bromo-6-chloro-4-fluorophenyl)pyridine-2-carboxamide
CID 107470670
5-bromo-N-(2,5-difluorophenyl)pyridine-2-carboxamide
CID 62952498
5-bromo-N-[4-fluoro-3-(hydroxymethyl)phenyl]pyridine-2-carboxamide
CID 90238784
5-bromo-N-(3-chloro-5-fluorophenyl)thiophene-2-carboxamide
CID 103774691
N-(3-amino-5-fluorophenyl)-5-fluoropyridine-2-carboxamide
CID 107333949
5-bromo-N-[4-(difluoromethoxy)phenyl]pyridine-2-carboxamide
CID 62953190
3-bromo-N-(3-chloro-5-fluorophenyl)-5-methylbenzamide
CID 107366667
N-(3,5-dichlorophenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639754

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide?
The IUPAC name of 5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide (CID 113259351) is 5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide is O=C(Nc1cc(F)cc(Cl)c1)c1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide?
The InChIKey is HVOQNBSXSMQLCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7BrClFN2O/c13-7-1-2-11(16-6-7)12(18)17-10-4-8(14)3-9(15)5-10/h1-6H,(H,17,18).
What are the key properties of 5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide?
5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide has a molecular weight of 329.56 g/mol, XLogP of 3.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(3-chloro-5-fluorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 113259351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).