1-Methyl-5-aminomethylimidazole

C₅H₉N₃CAS 486414-86-2111.15 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₉N₃
Molar mass: 111.15 g/mol
Exact mass: 111.0796 Da
logP: -0.12Crippen estimate
Polar surface area: 43.8 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

486414-86-2

SMILES

CN1C=NC=C1CN

InChIKey

PYAQTQXFMQWCHQ-UHFFFAOYSA-N

InChI

InChI=1S/C5H9N3/c1-8-4-7-3-5(8)2-6/h3-4H,2,6H2,1H3

Weigh it out

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

Names and synonyms

1 names

(1-Methyl-1H-imidazol-5-yl)methylamine

Work with 1-Methyl-5-aminomethylimidazole

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-Methylhistidine368-16-145 % similar 5-Chloro-1-methyl-1H-imidazole872-49-145 % similar 5-Bromo-1-methyl-1H-imidazole1003-21-043 % similar 5-Iodo-1-methyl-1H-imidazole71759-88-143 % similar Anserine584-85-040 % similar 1-Methyl-1H-imidazole-5-carbaldehyde39021-62-039 % similar (1,3-Dimethyl-1H-pyrazol-5-yl)methylamine499770-63-737 % similar Pilocarpine92-13-737 % similar

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

Same formula

2-Pyrazol-1-ylethylamin101395-71-5 5-Amino-3-ethyl-1H-pyrazole1904-24-1 1,3-Dimethyl-1H-pyrazol-5-amine3524-32-1 5-Amino-1-ethylpyrazole3528-58-3 (1-Methyl-1H-imidazol-4-yl)methanamine486414-83-9 Histamine51-45-6 1,3-Dimethyl-1H-pyrazol-4-amine64517-88-0 1-Ethyl-1H-pyrazol-4-amine876343-24-7

Elsewhere

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