5-Amino-1-methyl-3-phenylpyrazole

C₁₀H₁₁N₃CAS 10199-50-5173.22 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₁₀H₁₁N₃
Molar mass: 173.22 g/mol
Exact mass: 173.0953 Da
logP: 1.67Crippen estimate
Polar surface area: 43.8 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed90.9% of notifiers
H315 Causes skin irritation11.4% of notifiers
H319 Causes serious eye irritation11.4% of notifiers
H335 May cause respiratory irritation11.4% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, 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

10199-50-5

SMILES

CN1C(=CC(=N1)C2=CC=CC=C2)N

InChIKey

KCYRMURRLLYLPU-UHFFFAOYSA-N

InChI

InChI=1S/C10H11N3/c1-13-10(11)7-9(12-13)8-5-3-2-4-6-8/h2-7H,11H2,1H3

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Names and synonyms

1 names

1-Methyl-3-phenyl-1H-pyrazol-5-amine

Work with 5-Amino-1-methyl-3-phenylpyrazole

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

1,3-Diphenyl-1H-pyrazol-5-amine5356-71-859 % similar 1,3-Dimethyl-1H-pyrazol-5-amine3524-32-148 % similar 3-(1,1-Dimethylethyl)-1-methyl-1H-pyrazol-5-amine118430-73-244 % similar 3-Cyclopropyl-1-methyl-1H-pyrazol-5-amine118430-74-343 % similar 4,6-Diphenylpyrimidin-2-amine40230-24-841 % similar 1-Methyl-1H-pyrazol-5-amine1192-21-838 % similar Methyl 5-amino-1-methyl-1H-pyrazole-3-carboxylate92406-53-638 % similar 5-Amino-3-phenylisoxazole4369-55-538 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Amino-3-methyl-1-phenylpyrazole1131-18-6 4-(1H-Pyrazol-1-ylmethyl)aniline142335-61-3 2-Amino-5,7-dimethyl-1,8-naphthyridine39565-07-6 5-Amino-3-methyl-4-phenylpyrazole60419-81-0 5-(4-Methylphenyl)-1H-pyrazol-3-amine78597-54-3

Elsewhere

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