4-Amino-1,2-dihydropyridin-2-one

C₅H₆N₂OCAS 38767-72-5110.12 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

H301 Toxic if swallowed25% of notifiers
H302 Harmful if swallowed75% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation75% of notifiers

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

38767-72-5

SMILES

C1=CNC(=O)C=C1N

InChIKey

SBQVQYPJWLJRQT-UHFFFAOYSA-N

InChI

InChI=1S/C5H6N2O/c6-4-1-2-7-5(8)3-4/h1-3H,(H3,6,7,8)

Weigh it out

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

Names and synonyms

1 names

4-Amino-pyridin-2-ol

Work with 4-Amino-1,2-dihydropyridin-2-one

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

2,4-Diaminopyridine461-88-154 % similar 2-Hydroxy-4-methylpyridine13466-41-652 % similar 4-Bromopyridin-2-ol36953-37-450 % similar 4-Chloro-2-hydroxypyridine40673-25-450 % similar 2,4-Dihydroxypyridine84719-31-350 % similar 2-Hydroxy-4-pyridinecarboxaldehyde188554-13-447 % similar 2(1H)-Quinolinone,6-amino-(9ci)79207-68-444 % similar 5-Aminoindole5192-03-043 % 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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