6-Bromo-N-methylpyridin-3-amine

C₆H₇BrN₂CAS 1022641-52-6187.04 g/mol

Open in Covalent MOL file

Aryl halide Secondary amine

Properties

Molecular formula: C₆H₇BrN₂
Molar mass: 187.04 g/mol
Exact mass: 185.9793 Da
logP: 1.89Crippen estimate
Polar surface area: 24.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

1022641-52-6

SMILES

CNC1=CN=C(C=C1)Br

InChIKey

OAXOGPDQYIWCST-UHFFFAOYSA-N

InChI

InChI=1S/C6H7BrN2/c1-8-5-2-3-6(7)9-4-5/h2-4,8H,1H3

Weigh it out

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

Names and synonyms

1 names

(6-Bromopyridin-3-yl)-methylamine

Work with 6-Bromo-N-methylpyridin-3-amine

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

2-Bromo-5-methylpyridine3510-66-548 % similar 2,5-Dibromopyridine624-28-246 % similar 4-Bromo-N-methylaniline6911-87-146 % similar 2-Bromo-5-methoxypyridine105170-27-244 % similar 6-Bromopyridin-3-amine13534-97-943 % similar 2-Bromo-5-chloropyridine40473-01-643 % similar 2-Bromo-5-fluoropyridine41404-58-443 % similar 2-Bromo-5-hydroxypyridine55717-40-343 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

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 5-Bromo-4,6-dimethylpyrimidine157335-97-2

Elsewhere

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