2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide

C12H6Br2F2N2O — CID 103759038

IUPAC2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide
SMILESO=C(Nc1c(F)cc(Br)cc1F)c1ccnc(Br)c1
InChIInChI=1S/C12H6Br2F2N2O/c13-7-4-8(15)11(9(16)5-7)18-12(19)6-1-2-17-10(14)3-6/h1-5H,(H,18,19)
InChIKeyUGMKJCGARYZKHX-UHFFFAOYSA-N
MW392.00 g/mol
LogP4.14
Rot. Bonds2

About 2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide

2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide (PubChem CID 103759038) has the molecular formula C12H6Br2F2N2O and a molecular weight of 392.00 g/mol. Its IUPAC name is 2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide
PubChem CID103759038
Molecular FormulaC12H6Br2F2N2O
Molecular Weight392.00 g/mol
Exact Mass389.88
IUPAC Name2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide
SMILESO=C(Nc1c(F)cc(Br)cc1F)c1ccnc(Br)c1
InChIInChI=1S/C12H6Br2F2N2O/c13-7-4-8(15)11(9(16)5-7)18-12(19)6-1-2-17-10(14)3-6/h1-5H,(H,18,19)
InChIKeyUGMKJCGARYZKHX-UHFFFAOYSA-N
XLogP4.14
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.00
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-bromo-2,6-difluorophenyl)-2-chloropyridine-4-carboxamide
CID 65469908
N-(4-bromo-2,6-difluorophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 65499839
2-bromo-N-(2,6-dichlorophenyl)pyridine-4-carboxamide
CID 114037407
3,5-dibromo-N-(4-bromo-2,6-difluorophenyl)benzamide
CID 107972354
2-bromo-N-(4-fluoro-3-methylphenyl)pyridine-4-carboxamide
CID 103755165
2-bromo-N-(2-bromo-5-fluorophenyl)pyridine-4-carboxamide
CID 103756062
2-bromo-N-(3-cyano-4-fluorophenyl)pyridine-4-carboxamide
CID 113255679
2-bromo-N-[2-fluoro-5-(trifluoromethyl)phenyl]pyridine-4-carboxamide
CID 103752711
2-bromo-N-(3-carbamoyl-4-fluorophenyl)pyridine-4-carboxamide
CID 103754415
2-bromo-N-(3-fluoro-4-nitrophenyl)pyridine-4-carboxamide
CID 103852327
2-[(2-bromopyridine-4-carbonyl)amino]pyridine-4-carboxylic acid
CID 114037370
2-bromo-N-[4-(carbamoylamino)phenyl]pyridine-4-carboxamide
CID 103752137

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide?
The IUPAC name of 2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide (CID 103759038) is 2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide is O=C(Nc1c(F)cc(Br)cc1F)c1ccnc(Br)c1.
What is the InChIKey of 2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide?
The InChIKey is UGMKJCGARYZKHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Br2F2N2O/c13-7-4-8(15)11(9(16)5-7)18-12(19)6-1-2-17-10(14)3-6/h1-5H,(H,18,19).
What are the key properties of 2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide?
2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide has a molecular weight of 392.00 g/mol, XLogP of 4.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(4-bromo-2,6-difluorophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 103759038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).