chempirical

2-Amino-5-methylnicotinaldehyde

C7H8N2OCAS 1023814-35-8136.15 g/mol

Open in Covalent MOL file
NNH2O
AldehydePrimary amine

Properties

Molecular formula
C7H8N2O
Molar mass
136.15 g/mol
Exact mass
136.0637 Da
logP
0.78Crippen estimate
Polar surface area
56.0 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
1023814-35-8
SMILES
CC1=CC(=C(N=C1)N)C=O
InChIKey
KHLBBDOMXLJWGR-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N2O/c1-5-2-6(4-10)7(8)9-3-5/h2-4H,1H3,(H2,8,9)

Weigh it out

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

Work with 2-Amino-5-methylnicotinaldehyde

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

Diformylcresol7310-95-444 % similar 2,5-Dimethylbenzaldehyde5779-94-243 % similar 5-Methylsalicylaldehyde613-84-341 % similar 2,4-Dimethylbenzaldehyde15764-16-639 % similar 2-Bromo-5-methyl-3-pyridinamine34552-14-238 % similar 2-Hydroxy-4-methylbenzaldehyde698-27-138 % similar 2,4,5-Trimethylbenzaldehyde5779-72-635 % similar 3-Methyl-1H-pyrazole-4-carbaldehyde112758-40-435 % similar

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

Same formula

Nicotinyl methylamide114-33-0 2-Acetyl-3-methylpyrazine23787-80-6 4-Aminobenzamide2835-68-9 Salicylhydrazone3291-00-7 3-Aminobenzamide3544-24-9 2-Amino-4,5-dimethylfuran-3-carbonitrile5117-88-4 N-2-Pyridinylacetamide5231-96-9 2-(1-Ethoxyethylidene)propanedinitrile5417-82-3

Elsewhere

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