A1H3U
Summary
| Name: | 1-[[5-[5-(1~{H}-pyrazol-5-yl)pyridin-2-yl]oxypyridin-2-yl]methyl]piperidin-4-ol |
| Synonyms: | LIPID FRAGMENT |
| Formula: | C19 H21 N5 O2 |
| Formal charge: | 0 |
| Formula weight: | 351.402 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-[[5-[5-(1~{H}-pyrazol-5-yl)pyridin-2-yl]oxypyridin-2-yl]methyl]piperidin-4-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C19H21N5O2/c25-16-6-9-24(10-7-16)13-15-2-3-17(12-20-15)26-19-4-1-14(11-21-19)18-5-8-22-23-18/h1-5,8,11-12,16,25H,6-7,9-10,13H2,(H,22,23) |
| InChIKey | InChI | 1.06 | UZAUVYWHEDBLBM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC1CCN(CC1)Cc2ccc(Oc3ccc(cn3)c4[nH]ncc4)cn2 |
| SMILES | CACTVS | 3.385 | OC1CCN(CC1)Cc2ccc(Oc3ccc(cn3)c4[nH]ncc4)cn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ncc1c2ccn[nH]2)Oc3ccc(nc3)CN4CCC(CC4)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ncc1c2ccn[nH]2)Oc3ccc(nc3)CN4CCC(CC4)O |
