N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine

C11H9BrF2N4 — CID 80931237

IUPACN-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine
SMILESNNc1cccc(Nc2c(F)cc(Br)cc2F)n1
InChIInChI=1S/C11H9BrF2N4/c12-6-4-7(13)11(8(14)5-6)17-9-2-1-3-10(16-9)18-15/h1-5H,15H2,(H2,16,17,18)
InChIKeyNUBYRTQPVNJKCI-UHFFFAOYSA-N
MW315.12 g/mol
LogP3.15
Rot. Bonds3

About N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine

N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine (PubChem CID 80931237) has the molecular formula C11H9BrF2N4 and a molecular weight of 315.12 g/mol. Its IUPAC name is N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine.

Molecular Properties

Compound NameN-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine
PubChem CID80931237
Molecular FormulaC11H9BrF2N4
Molecular Weight315.12 g/mol
Exact Mass314.00
IUPAC NameN-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine
SMILESNNc1cccc(Nc2c(F)cc(Br)cc2F)n1
InChIInChI=1S/C11H9BrF2N4/c12-6-4-7(13)11(8(14)5-6)17-9-2-1-3-10(16-9)18-15/h1-5H,15H2,(H2,16,17,18)
InChIKeyNUBYRTQPVNJKCI-UHFFFAOYSA-N
XLogP3.15
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.12
LogP ≤ 53.15
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

N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyrimidin-4-amine
CID 80930315
N-(4-bromo-2,6-difluorophenyl)-6-hydrazinyl-3-nitropyridin-2-amine
CID 80923986
6-hydrazinyl-N-(2,3,5-trifluorophenyl)pyridin-2-amine
CID 80918997
2-tert-butyl-N-(2,6-difluorophenyl)-6-hydrazinylpyrimidin-4-amine
CID 80969498
[6-(5-bromo-2-fluorophenoxy)-2-pyridinyl]hydrazine
CID 114677416
3-N-(4-bromo-2,6-difluorophenyl)quinoxaline-2,3-diamine
CID 102986610
2-N-(4-bromo-2,6-difluorophenyl)-6-propoxypyridine-2,5-diamine
CID 65467537
N-(3,4-dichlorophenyl)-6-hydrazinylpyridin-2-amine
CID 80926061
N-(4-fluoro-2-methoxyphenyl)-6-hydrazinylpyridin-2-amine
CID 80904650
N-(2,6-difluorophenyl)-6-hydrazinyl-2-propylpyrimidin-4-amine
CID 80946886
N-(5-chloro-2-methylphenyl)-6-hydrazinylpyridin-2-amine
CID 80916740
N-(2,6-difluorophenyl)-2-hydrazinyl-6-methylpyrimidin-4-amine
CID 80921095

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine?
The IUPAC name of N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine (CID 80931237) is N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine.
What is the SMILES notation for N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine?
The canonical SMILES for N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine is NNc1cccc(Nc2c(F)cc(Br)cc2F)n1.
What is the InChIKey of N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine?
The InChIKey is NUBYRTQPVNJKCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrF2N4/c12-6-4-7(13)11(8(14)5-6)17-9-2-1-3-10(16-9)18-15/h1-5H,15H2,(H2,16,17,18).
What are the key properties of N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine?
N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine has a molecular weight of 315.12 g/mol, XLogP of 3.15, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2,6-difluorophenyl)-6-hydrazinylpyridin-2-amine is sourced from PubChem (CID 80931237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).