P3J
Summary
Name: | 3-(PYRIDIN-3-YL)-1H-PYRAZOL-5-AMINE |
Formula: | C8 H8 N4 |
Formal charge: | 0 |
Formula weight: | 160.176 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 3-(pyridin-3-yl)-1H-pyrazol-5-amine |
OpenEye OEToolkits | 1.9.2 | 3-pyridin-3-yl-1H-pyrazol-5-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | n1cccc(c1)c2nnc(c2)N |
InChI | InChI | 1.03 | InChI=1S/C8H8N4/c9-8-4-7(11-12-8)6-2-1-3-10-5-6/h1-5H,(H3,9,11,12) |
InChIKey | InChI | 1.03 | USKHSGIEOVXVFW-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1[nH]nc(c1)c2cccnc2 |
SMILES | CACTVS | 3.385 | Nc1[nH]nc(c1)c2cccnc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc(cnc1)c2cc([nH]n2)N |
SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(cnc1)c2cc([nH]n2)N |