chempirical

3-Bromo-5-methyl-4-pyridinamine

C6H7BrN2CAS 97944-43-9187.04 g/mol

Open in Covalent MOL file
NHBrHN
Aryl halide

Properties

Molecular formula
C6H7BrN2
Molar mass
187.04 g/mol
Exact mass
185.9793 Da
Melting point
115 °C
logP
1.57Crippen estimate
Polar surface area
39.6 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
0

Identifiers

CAS number
97944-43-9
SMILES
Cc1c[nH]cc(Br)c1=N
InChIKey
GUAFGBUKLIFASX-UHFFFAOYSA-N
InChI
InChI=1S/C6H7BrN2/c1-4-2-9-3-5(7)6(4)8/h2-3H,1H3,(H2,8,9)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • 4-Pyridinamine, 3-bromo-5-methyl-
  • 4-Amino-5-bromo-3-methylpyridine
  • 3-Bromo-5-methyl-1,4-dihydropyridin-4-imine

Work with 3-Bromo-5-methyl-4-pyridinamine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

5-Bromo-3,4-pyridinediamine4635-08-953 % similar 3-Methyl-4-pyridinamine1990-90-538 % similar 2,5-Dibromo-P-xylene1074-24-437 % similar 1,5-Dibromo-2,4-dimethylbenzene615-87-236 % similar 5-Bromo-3,4-dimethyl-2-pyridinamine374537-97-035 % similar 4-Amino-3,5-dichloropyridine22889-78-734 % similar 1-Bromo-2,4,5-trimethylbenzene5469-19-234 % similar 2-Amino-5-bromo-3-methylpyridine3430-21-534 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

6-Bromo-N-methylpyridin-3-amine1022641-52-6 4-Amino-5-bromo-2-methylpyridine10460-50-1 2-Amino-3-bromo-6-methylpyridine126325-46-0 6-Bromo-2-methyl-3-pyridinamine126325-47-1 4-Bromo-2-methyl-3-pyridinamine126325-48-2 2-Bromo-4-methyl-3-pyridinamine126325-50-6 2-Bromo-6-methyl-3-pyridinamine126325-53-9 6-Bromo-4-methylpyridin-3-amine156118-16-0

Elsewhere

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