3-Aminopyridin-4-ol

C₅H₆N₂OCAS 6320-39-4110.12 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₅H₆N₂O
Molar mass: 110.12 g/mol
Exact mass: 110.0480 Da
logP: -0.04Crippen estimate
Polar surface area: 58.9 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

Danger

H302 Harmful if swallowed33.3% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage22.2% of notifiers
H319 Causes serious eye irritation77.8% of notifiers
H335 May cause respiratory irritation88.9% of notifiers

Aggregated from 9 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+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

6320-39-4

SMILES

C1=CNC=C(C1=O)N

InChIKey

OIIBRAGQGFLUFI-UHFFFAOYSA-N

InChI

InChI=1S/C5H6N2O/c6-4-3-7-2-1-5(4)8/h1-3H,6H2,(H,7,8)

Weigh it out

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

Work with 3-Aminopyridin-4-ol

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

3-Chloro-4-hydroxypyridine89284-20-852 % similar 3-Methyl-4-hydroxypyridine22280-02-050 % similar 3-Fluoro-4-pyridinol22282-73-150 % similar 3-Bromo-4-pyridinol36953-41-050 % similar 3,4-Diaminopyridine54-96-650 % similar 4-Hydroxy-3-pyridinesulfonic acid51498-37-444 % similar 3-Nitro-4-pyridinol5435-54-142 % similar 4-Hydroxynicotinic acid609-70-142 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Methyl-1H-pyrazole-4-carbaldehyde112758-40-4 6-Methylpyridazin-3(2H)-one13327-27-0 1-Methyl-2-imidazolecarboxaldehyde13750-81-7 3-Hydroxypentanedinitrile13880-89-2 2-Aminopyridine N-oxide14150-95-9 4-Methylpyrimidin-2-ol hydrochloride15231-48-8 2-Amino-3-hydroxypyridine16867-03-1 1-Methyl-1H-imidazole-4-carbaldehyde17289-26-8

Elsewhere

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