5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide

C12H8Br2F2N4O — CID 62243354

IUPAC5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide
SMILESNNc1ncc(Br)cc1C(=O)Nc1c(F)cc(F)cc1Br
InChIInChI=1S/C12H8Br2F2N4O/c13-5-1-7(11(20-17)18-4-5)12(21)19-10-8(14)2-6(15)3-9(10)16/h1-4H,17H2,(H,18,20)(H,19,21)
InChIKeyRUEFKYSYMMSGMH-UHFFFAOYSA-N
MW422.03 g/mol
LogP3.42
Rot. Bonds3

About 5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide

5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide (PubChem CID 62243354) has the molecular formula C12H8Br2F2N4O and a molecular weight of 422.03 g/mol. Its IUPAC name is 5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide
PubChem CID62243354
Molecular FormulaC12H8Br2F2N4O
Molecular Weight422.03 g/mol
Exact Mass419.90
IUPAC Name5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide
SMILESNNc1ncc(Br)cc1C(=O)Nc1c(F)cc(F)cc1Br
InChIInChI=1S/C12H8Br2F2N4O/c13-5-1-7(11(20-17)18-4-5)12(21)19-10-8(14)2-6(15)3-9(10)16/h1-4H,17H2,(H,18,20)(H,19,21)
InChIKeyRUEFKYSYMMSGMH-UHFFFAOYSA-N
XLogP3.42
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.03
LogP ≤ 53.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-bromo-N-(2,6-dichlorophenyl)-2-hydrazinylpyridine-3-carboxamide
CID 65498887
5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-hydrazinylpyridine-3-carboxamide
CID 83170019
5-bromo-N-(2-fluoro-5-methylphenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62242736
5-amino-N-(2-bromo-4,6-difluorophenyl)pyrazine-2-carboxamide
CID 107374421
5-bromo-2-(methylamino)-N-(2,3,5-trifluorophenyl)pyridine-3-carboxamide
CID 62812436
3-amino-N-(2-bromo-4,6-difluorophenyl)-2,5-difluorobenzamide
CID 107120482
2-amino-N-(2-bromo-4,6-difluorophenyl)-4-fluorobenzamide
CID 63109685
5-bromo-N-tert-butyl-2-hydrazinylpyridine-3-carboxamide
CID 62238273
(2-bromo-4,6-difluorophenyl)urea
CID 43347715
5-bromo-N-(4-cyanophenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62249046
5-bromo-2-hydrazinyl-N-(4,4,4-trifluorobutyl)pyridine-3-carboxamide
CID 113328075
5-bromo-N-[(3-fluorophenyl)methyl]-2-hydrazinylpyridine-3-carboxamide
CID 62241265

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide (CID 62243354) is 5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide is NNc1ncc(Br)cc1C(=O)Nc1c(F)cc(F)cc1Br.
What is the InChIKey of 5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide?
The InChIKey is RUEFKYSYMMSGMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Br2F2N4O/c13-5-1-7(11(20-17)18-4-5)12(21)19-10-8(14)2-6(15)3-9(10)16/h1-4H,17H2,(H,18,20)(H,19,21).
What are the key properties of 5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide?
5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide has a molecular weight of 422.03 g/mol, XLogP of 3.42, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-bromo-4,6-difluorophenyl)-2-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 62243354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).