N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide

C13H12Br2N4O — CID 107603475

IUPACN-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
SMILESCc1cc(NN)c(C(=O)Nc2c(Br)cccc2Br)cn1
InChIInChI=1S/C13H12Br2N4O/c1-7-5-11(19-16)8(6-17-7)13(20)18-12-9(14)3-2-4-10(12)15/h2-6H,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyAGSAFEHWTPJQFD-UHFFFAOYSA-N
MW400.07 g/mol
LogP3.45
Rot. Bonds3

About N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide

N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide (PubChem CID 107603475) has the molecular formula C13H12Br2N4O and a molecular weight of 400.07 g/mol. Its IUPAC name is N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
PubChem CID107603475
Molecular FormulaC13H12Br2N4O
Molecular Weight400.07 g/mol
Exact Mass397.94
IUPAC NameN-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
SMILESCc1cc(NN)c(C(=O)Nc2c(Br)cccc2Br)cn1
InChIInChI=1S/C13H12Br2N4O/c1-7-5-11(19-16)8(6-17-7)13(20)18-12-9(14)3-2-4-10(12)15/h2-6H,16H2,1H3,(H,17,19)(H,18,20)
InChIKeyAGSAFEHWTPJQFD-UHFFFAOYSA-N
XLogP3.45
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.07
LogP ≤ 53.45
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-(5-bromo-2-pyridinyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256857
N-(2-bromo-5-chlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81272267
4-hydrazinyl-6-methyl-N-pyridin-2-ylpyridine-3-carboxamide
CID 81256191
N-(5-bromo-2-methoxyphenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81245507
4-(2,6-dibromoanilino)-6-methylpyridine-3-carboxylic acid
CID 107600873
4-hydrazinyl-6-methyl-N-pyrimidin-5-ylpyridine-3-carboxamide
CID 107590009
N-(3,5-dichlorophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256534
N-(4-ethylphenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide
CID 81256559
N-(2,6-dibromo-4-methylphenyl)-4-hydrazinylpyridine-3-carboxamide
CID 81256030
4-hydrazinyl-6-methylpyridine-3-carboxylic acid
CID 82863432
N-(2,6-dimethylphenyl)-4-(ethylamino)-6-methylpyridine-3-carboxamide
CID 81237854
4-hydrazinyl-6-methyl-N-(1,2,4-triazin-3-yl)pyridine-3-carboxamide
CID 114389592

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The IUPAC name of N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide (CID 107603475) is N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The canonical SMILES for N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide is Cc1cc(NN)c(C(=O)Nc2c(Br)cccc2Br)cn1.
What is the InChIKey of N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
The InChIKey is AGSAFEHWTPJQFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Br2N4O/c1-7-5-11(19-16)8(6-17-7)13(20)18-12-9(14)3-2-4-10(12)15/h2-6H,16H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide?
N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide has a molecular weight of 400.07 g/mol, XLogP of 3.45, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dibromophenyl)-4-hydrazinyl-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 107603475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).