5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide

C12H9Br2ClN4O — CID 107603472

IUPAC5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide
SMILESNNc1ncc(C(=O)Nc2c(Br)cccc2Br)cc1Cl
InChIInChI=1S/C12H9Br2ClN4O/c13-7-2-1-3-8(14)10(7)18-12(20)6-4-9(15)11(19-16)17-5-6/h1-5H,16H2,(H,17,19)(H,18,20)
InChIKeyYXAIHHUNDUIBQA-UHFFFAOYSA-N
MW420.49 g/mol
LogP3.80
Rot. Bonds3

About 5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide

5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide (PubChem CID 107603472) has the molecular formula C12H9Br2ClN4O and a molecular weight of 420.49 g/mol. Its IUPAC name is 5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide
PubChem CID107603472
Molecular FormulaC12H9Br2ClN4O
Molecular Weight420.49 g/mol
Exact Mass417.88
IUPAC Name5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide
SMILESNNc1ncc(C(=O)Nc2c(Br)cccc2Br)cc1Cl
InChIInChI=1S/C12H9Br2ClN4O/c13-7-2-1-3-8(14)10(7)18-12(20)6-4-9(15)11(19-16)17-5-6/h1-5H,16H2,(H,17,19)(H,18,20)
InChIKeyYXAIHHUNDUIBQA-UHFFFAOYSA-N
XLogP3.80
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.49
LogP ≤ 53.80
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-chloro-N-(2,3-difluorophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 62236975
5-chloro-6-hydrazinyl-N-(3-propan-2-ylphenyl)pyridine-3-carboxamide
CID 62243463
5-chloro-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyridine-3-carboxamide
CID 62235361
5-chloro-N-(5-fluoro-2-pyridinyl)-6-hydrazinylpyridine-3-carboxamide
CID 65481484
5-bromo-N-(2,6-dichlorophenyl)-2-hydrazinylpyridine-3-carboxamide
CID 65498887
N-[1-(3-bromophenyl)ethyl]-5-chloro-6-hydrazinylpyridine-3-carboxamide
CID 62237377
5-chloro-N-(4-cyanophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 62248864
5-chloro-N-(2-cyano-3-methylphenyl)-6-hydrazinylpyridine-3-carboxamide
CID 107801438
N-(4-bromo-2,6-dichlorophenyl)-6-hydrazinylpyridine-3-carboxamide
CID 62244012
N-(2,6-dibromophenyl)-6-fluoropyridine-3-carboxamide
CID 107598690
5-chloro-6-hydrazinyl-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 62249389
N-(4-bromo-2,6-dimethylphenyl)-5-chloro-6-(methylamino)pyridine-3-carboxamide
CID 62185392

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide (CID 107603472) is 5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide is NNc1ncc(C(=O)Nc2c(Br)cccc2Br)cc1Cl.
What is the InChIKey of 5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide?
The InChIKey is YXAIHHUNDUIBQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Br2ClN4O/c13-7-2-1-3-8(14)10(7)18-12(20)6-4-9(15)11(19-16)17-5-6/h1-5H,16H2,(H,17,19)(H,18,20).
What are the key properties of 5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide?
5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide has a molecular weight of 420.49 g/mol, XLogP of 3.80, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,6-dibromophenyl)-6-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 107603472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).