chempirical

4-Amino-1-methylpyridin-2(1H)-one

C6H8N2OCAS 952182-01-3124.14 g/mol

Open in Covalent MOL file
NONH2
Primary amine

Properties

Molecular formula
C6H8N2O
Molar mass
124.14 g/mol
Exact mass
124.0637 Da
logP
-0.03Crippen estimate
Polar surface area
48.0 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
952182-01-3
SMILES
CN1C=CC(=CC1=O)N
InChIKey
CRGNLDFNDMPVBN-UHFFFAOYSA-N
InChI
InChI=1S/C6H8N2O/c1-8-3-2-5(7)4-6(8)9/h2-4H,7H2,1H3

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Names and synonyms

1 names
  • 4-Amino-1-methylpyridin-2-one

Work with 4-Amino-1-methylpyridin-2(1H)-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

4-Bromo-1-methylpyridin-2(1H)-one214342-63-955 % similar 1-Methyl-1H-indol-5-amine102308-97-448 % similar 1-Methyl-2(1H)-pyridinone694-85-947 % similar 1,3-Dimethyluracil874-14-642 % similar 1-Methyl-1H-benzimidazol-6-amine26530-93-838 % similar Imidazo[1,2-A]pyridin-7-amine (9ci)421595-81-533 % similar 6-Amino-1,3-dimethyluracil6642-31-533 % similar 1-Methyluracil615-77-032 % similar

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

Same formula

2-Amino-5-methoxypyridine10167-97-2 2-Amino-4-methoxypyridine10201-73-7 (2-Aminopyridin-4-yl)methanol105250-17-7 2-Hydroxy-4,6-dimethylpyrimidine108-79-2 (6-Amino-3-pyridinyl)methanol113293-71-3 4-Aminopyridine-3-methanol138116-34-4 Bis(2-cyanoethyl) ether1656-48-0 2-Amino-6-methoxypyridine17920-35-3

Elsewhere

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