chempirical

(1,5-Dimethyl-1H-pyrazol-3-yl)methanamine

C6H11N3CAS 423768-52-9125.18 g/mol

Open in Covalent MOL file
NNNH2
Primary amine

Properties

Molecular formula
C6H11N3
Molar mass
125.18 g/mol
Exact mass
125.0953 Da
logP
0.19Crippen estimate
Polar surface area
43.8 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number
423768-52-9
SMILES
CC1=CC(=NN1C)CN
InChIKey
JGYXJOBBROGMLL-UHFFFAOYSA-N
InChI
InChI=1S/C6H11N3/c1-5-3-6(4-7)8-9(5)2/h3H,4,7H2,1-2H3

Weigh it out

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Names and synonyms

1 names
  • (1,5-Dimethyl-1H-pyrazol-3-yl)methylamine

Work with (1,5-Dimethyl-1H-pyrazol-3-yl)methanamine

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

(1,5-Dimethyl-1H-pyrazol-3-yl)methanol153912-60-861 % similar 3-(Chloromethyl)-1,5-dimethyl-1H-pyrazole180519-09-961 % similar 1,3,5-Trimethylpyrazole1072-91-950 % similar 1,5-Dimethyl-1H-pyrazole-3-carboxylic acid5744-59-239 % similar Ethyl 1,5-dimethyl-1H-pyrazole-3-carboxylate5744-51-438 % similar (1-Methyl-1H-imidazol-4-yl)methanamine486414-83-937 % similar 2-(3,5-Dimethyl-1H-pyrazol-1-yl)ethan-1-amine62821-88-935 % similar 2-(Aminomethyl)-5-methylpyrazine132664-85-834 % similar

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

Same formula

4-Isopropyl-1H-pyrazol-3-amine151521-49-2 1,3,5-Trimethyl-1H-pyrazol-4-amine28466-21-9 (1,3-Dimethyl-1H-pyrazol-5-yl)methylamine499770-63-7 1H-Imidazole-1-propanamine5036-48-6

Elsewhere

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