3-(4-Chlorophenyl)-1H-pyrazol-5-amine

C₉H₈ClN₃CAS 78583-81-0193.63 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₉H₈ClN₃
Molar mass: 193.63 g/mol
Exact mass: 193.0407 Da
logP: 2.31Crippen estimate
Polar surface area: 54.7 Å²
H-bond donors / acceptors: 2 / 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

78583-81-0

SMILES

C1=CC(=CC=C1C2=CC(=NN2)N)Cl

InChIKey

XQPBZIITFQHIDI-UHFFFAOYSA-N

InChI

InChI=1S/C9H8ClN3/c10-7-3-1-6(2-4-7)8-5-9(11)13-12-8/h1-5H,(H3,11,12,13)

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Names and synonyms

1 names

3-Amino-5-(4-chlorophenyl)pyrazole

Work with 3-(4-Chlorophenyl)-1H-pyrazol-5-amine

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-Amino-5-phenylpyrazole827-41-865 % similar 5-Amino-3-(4-methoxyphenyl)pyrazole19541-95-858 % similar 5-(4-Nitrophenyl)-2H-pyrazol-3-ylamine78583-83-254 % similar 3-(4-Chlorophenyl)-1H-pyrazole59843-58-247 % similar 4-Amino-4'-chlorodiphenyl135-68-241 % similar 2-(4-Chlorophenyl)-1H-indole1211-35-439 % similar 4,4′-Dichlorobiphenyl2050-68-239 % similar 4-Chloroaniline106-47-835 % similar

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

Same formula

7-Chloro-4-hydrazinylquinoline23834-14-2 5-Chloromethyl-2-(pyrazol-1-yl)pyridine748796-39-6

Elsewhere

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