4-bromo-6-(difluoromethyl)pyridine-3-carboxamide

C7H5BrF2N2O — CID 118851035

IUPAC4-bromo-6-(difluoromethyl)pyridine-3-carboxamide
SMILESNC(=O)c1cnc(C(F)F)cc1Br
InChIInChI=1S/C7H5BrF2N2O/c8-4-1-5(6(9)10)12-2-3(4)7(11)13/h1-2,6H,(H2,11,13)
InChIKeyDYZGBUQWSCWRDW-UHFFFAOYSA-N
MW251.03 g/mol
LogP1.88
Rot. Bonds2

About 4-bromo-6-(difluoromethyl)pyridine-3-carboxamide

4-bromo-6-(difluoromethyl)pyridine-3-carboxamide (PubChem CID 118851035) has the molecular formula C7H5BrF2N2O and a molecular weight of 251.03 g/mol. Its IUPAC name is 4-bromo-6-(difluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-bromo-6-(difluoromethyl)pyridine-3-carboxamide
PubChem CID118851035
Molecular FormulaC7H5BrF2N2O
Molecular Weight251.03 g/mol
Exact Mass249.96
IUPAC Name4-bromo-6-(difluoromethyl)pyridine-3-carboxamide
SMILESNC(=O)c1cnc(C(F)F)cc1Br
InChIInChI=1S/C7H5BrF2N2O/c8-4-1-5(6(9)10)12-2-3(4)7(11)13/h1-2,6H,(H2,11,13)
InChIKeyDYZGBUQWSCWRDW-UHFFFAOYSA-N
XLogP1.88
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.03
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 2-[4-bromo-6-(difluoromethyl)-3-pyridinyl]acetate
CID 134672940
4-bromo-6-(difluoromethyl)-5-iodopyridine-3-carboxamide
CID 118806222
4-bromo-5-(difluoromethyl)-6-methylpyridine-3-carboxamide
CID 118844639
5-bromo-2-(difluoromethyl)pyridine-4-sulfonamide
CID 130095357
5-(difluoromethyl)-4,6-dimethylpyridine-3-carboxamide
CID 130101517
4-bromo-2-(difluoromethyl)-5-nitropyridine
CID 118811909
5-bromo-2-(difluoromethyl)-4-iodopyridine
CID 130095026
6-(difluoromethyl)-5-hydroxy-4-methylpyridine-3-carboxamide
CID 130084161
2-(difluoromethyl)-5-fluoropyridine-4-carboxylic acid
CID 118809173
ethyl 6-(difluoromethyl)-4-fluoropyridine-3-carboxylate
CID 133091151
ethyl 4-bromo-6-propan-2-ylpyridine-3-carboxylate
CID 172993527
2,3-diamino-6-(difluoromethyl)pyridine-4-carboxamide
CID 119018170

Frequently Asked Questions

What is the IUPAC name of 4-bromo-6-(difluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 4-bromo-6-(difluoromethyl)pyridine-3-carboxamide (CID 118851035) is 4-bromo-6-(difluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-bromo-6-(difluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-bromo-6-(difluoromethyl)pyridine-3-carboxamide is NC(=O)c1cnc(C(F)F)cc1Br.
What is the InChIKey of 4-bromo-6-(difluoromethyl)pyridine-3-carboxamide?
The InChIKey is DYZGBUQWSCWRDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5BrF2N2O/c8-4-1-5(6(9)10)12-2-3(4)7(11)13/h1-2,6H,(H2,11,13).
What are the key properties of 4-bromo-6-(difluoromethyl)pyridine-3-carboxamide?
4-bromo-6-(difluoromethyl)pyridine-3-carboxamide has a molecular weight of 251.03 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-6-(difluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 118851035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).