6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide

C7H4BrF3N2O — CID 119015693

IUPAC6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide
SMILESNC(=O)c1cc(F)c(C(F)F)c(Br)n1
InChIInChI=1S/C7H4BrF3N2O/c8-5-4(6(10)11)2(9)1-3(13-5)7(12)14/h1,6H,(H2,12,14)
InChIKeyWJYFXMMDIKPUPN-UHFFFAOYSA-N
MW269.02 g/mol
LogP2.02
Rot. Bonds2

About 6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide

6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide (PubChem CID 119015693) has the molecular formula C7H4BrF3N2O and a molecular weight of 269.02 g/mol. Its IUPAC name is 6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide.

Molecular Properties

Compound Name6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide
PubChem CID119015693
Molecular FormulaC7H4BrF3N2O
Molecular Weight269.02 g/mol
Exact Mass267.95
IUPAC Name6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide
SMILESNC(=O)c1cc(F)c(C(F)F)c(Br)n1
InChIInChI=1S/C7H4BrF3N2O/c8-5-4(6(10)11)2(9)1-3(13-5)7(12)14/h1,6H,(H2,12,14)
InChIKeyWJYFXMMDIKPUPN-UHFFFAOYSA-N
XLogP2.02
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.02
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-bromo-5-(difluoromethyl)-4-fluoropyridine-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

6-cyano-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide
CID 118992430
[6-bromo-5-(difluoromethyl)-4-fluoro-2-pyridinyl]methanol
CID 119022962
ethyl 2-[6-bromo-5-(difluoromethyl)-4-fluoro-2-pyridinyl]acetate
CID 134663511
4-bromo-5-(difluoromethyl)-6-nitropyridine-2-carboxamide
CID 118811757
5-(difluoromethyl)-4,6-dimethylpyridine-2-carboxamide
CID 130101518
3-(difluoromethyl)-4-fluoro-6-methylpyridine-2-carboxamide
CID 130081330
4-(difluoromethyl)-5,6-difluoropyridine-2-carboxamide
CID 119022721
6-(aminomethyl)-5-(difluoromethyl)-4-fluoropyridine-2-carboxylic acid
CID 118814114
4-chloro-6-(difluoromethyl)-5-fluoropyridine-2-carboxamide
CID 130072220
6-amino-2-bromo-3-(difluoromethyl)pyridine-4-carboxylic acid
CID 130102115
2-bromo-4-(difluoromethyl)-6-fluoropyridine-3-carboxamide
CID 119010970
4-(difluoromethyl)-5-fluoro-6-methylpyridine-2-carboxamide
CID 118851932

Frequently Asked Questions

What is the IUPAC name of 6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide?
The IUPAC name of 6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide (CID 119015693) is 6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide.
What is the SMILES notation for 6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide?
The canonical SMILES for 6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide is NC(=O)c1cc(F)c(C(F)F)c(Br)n1.
What is the InChIKey of 6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide?
The InChIKey is WJYFXMMDIKPUPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4BrF3N2O/c8-5-4(6(10)11)2(9)1-3(13-5)7(12)14/h1,6H,(H2,12,14).
What are the key properties of 6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide?
6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide has a molecular weight of 269.02 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-5-(difluoromethyl)-4-fluoropyridine-2-carboxamide is sourced from PubChem (CID 119015693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).