4-Phenyl-1H-pyrazol-5-amine

C9H9N3CAS 57999-06-1159.19 g/mol

Open in Covalent MOL file
NHNH2N
Primary amine

Properties

Molecular formula
C9H9N3
Molar mass
159.19 g/mol
Exact mass
159.0796 Da
logP
1.66Crippen estimate
Polar surface area
54.7 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 43 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
57999-06-1
SMILES
C1=CC=C(C=C1)C2=C(NN=C2)N
InChIKey
QEHKQNYBBLCFIJ-UHFFFAOYSA-N
InChI
InChI=1S/C9H9N3/c10-9-8(6-11-12-9)7-4-2-1-3-5-7/h1-6H,(H3,10,11,12)

Weigh it out

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

Work with 4-Phenyl-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-4-bromopyrazole16461-94-242 % similar 2-Aminobiphenyl90-41-540 % similar 6-Chloro-3-phenyl-2-pyridinamine69214-19-339 % similar O-Terphenyl84-15-138 % similar 4-Isopropyl-1H-pyrazol-3-amine151521-49-238 % similar 3-Phenyl-1H-pyrazole-4-carbaldehyde26033-20-538 % similar 4-Bromo-3-phenyl-1H-pyrazol-5-amine2845-78-538 % similar 5-Amino-3-methyl-4-phenylpyrazole60419-81-038 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Amino-5-phenylpyrazole1572-10-7 2-Hydrazinoquinoline15793-77-8 4-(1H-Pyrazol-1-yl)aniline17635-45-9 4-(1H-Imidazol-1-yl)aniline2221-00-3 3-Amino-5-phenylpyrazole827-41-8

Elsewhere

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