Z5P

1-[2-(1H-pyrazol-1-yl)phenyl]methanamine

Created: 2012-02-07
Last modified:  2014-09-05

Find related ligands:

Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count0
Bond Count25
Aromatic Bond Count11
2D diagram of Z5P

Chemical Component Summary

Name1-[2-(1H-pyrazol-1-yl)phenyl]methanamine
Systematic Name (OpenEye OEToolkits)(2-pyrazol-1-ylphenyl)methanamine
FormulaC10 H11 N3
Molecular Weight173.214
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01n1cccn1c2c(cccc2)CN
SMILESCACTVS3.385NCc1ccccc1n2cccn2
SMILESOpenEye OEToolkits1.9.2c1ccc(c(c1)CN)n2cccn2
Canonical SMILESCACTVS3.385 NCc1ccccc1n2cccn2
Canonical SMILESOpenEye OEToolkits1.9.2 c1ccc(c(c1)CN)n2cccn2
InChIInChI1.03 InChI=1S/C10H11N3/c11-8-9-4-1-2-5-10(9)13-7-3-6-12-13/h1-7H,8,11H2
InChIKeyInChI1.03 SJMJUZRSTJBVPG-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 7015036