9EZ

2-methyl-5-phenyl-pyrazol-3-amine

Created: 2017-05-15
Last modified:  2017-06-14

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Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count0
Bond Count25
Aromatic Bond Count11
2D diagram of 9EZ

Chemical Component Summary

Name2-methyl-5-phenyl-pyrazol-3-amine
Systematic Name (OpenEye OEToolkits)2-methyl-5-phenyl-pyrazol-3-amine
FormulaC10 H11 N3
Molecular Weight173.214
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385Cn1nc(cc1N)c2ccccc2
SMILESOpenEye OEToolkits2.0.6Cn1c(cc(n1)c2ccccc2)N
Canonical SMILESCACTVS3.385 Cn1nc(cc1N)c2ccccc2
Canonical SMILESOpenEye OEToolkits2.0.6 Cn1c(cc(n1)c2ccccc2)N
InChIInChI1.03 InChI=1S/C10H11N3/c1-13-10(11)7-9(12-13)8-5-3-2-4-6-8/h2-7H,11H2,1H3
InChIKeyInChI1.03 KCYRMURRLLYLPU-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 517779
ChEMBL CHEMBL4084029