chempirical

5-Bromo-3-methoxypyridin-2-amine

C6H7BrN2OCAS 42409-58-5203.04 g/mol

Open in Covalent MOL file
ONBrH2N
Aryl halideEtherPrimary amine

Properties

Molecular formula
C6H7BrN2O
Molar mass
203.04 g/mol
Exact mass
201.9742 Da
logP
1.43Crippen estimate
Polar surface area
48.1 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
42409-58-5
SMILES
COC1=C(N=CC(=C1)Br)N
InChIKey
NFBIWMFMHLPVLT-UHFFFAOYSA-N
InChI
InChI=1S/C6H7BrN2O/c1-10-5-2-4(7)3-9-6(5)8/h2-3H,1H3,(H2,8,9)

Weigh it out

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

Work with 5-Bromo-3-methoxypyridin-2-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

5-Bromo-3-methoxy-2-methylpyridine1150617-80-361 % similar 5-Bromo-2-chloro-3-methoxypyridine286947-03-359 % similar 2,3-Diamino-5-bromopyridine38875-53-558 % similar 2-Amino-3,5-dibromopyridine35486-42-153 % similar 2-Amino-5-bromo-3-iodopyridine381233-96-150 % similar 5-Bromo-3-chloropyridin-2-amine38185-55-650 % similar 2-Amino-5-bromo-3-hydroxypyridine39903-01-050 % similar 4-Bromo-2-methoxybenzenamine59557-91-450 % similar

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

Same formula

5-Bromo-6-methoxypyridin-2-amine1211533-83-3 2-Amino-5-bromo-3-(hydroxymethyl)pyridine335031-01-1 5-Amino-3-bromo-2-methoxypyridine53242-18-5 6-Bromo-2-methoxy-3-pyridinamine89466-18-2

Elsewhere

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