Q10
Summary
| Name: | 6-{[3-(3-aminopropoxy)phenoxy]methyl}-4-methylpyridin-2-amine |
| Formula: | C16 H21 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 287.357 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6-{[3-(3-aminopropoxy)phenoxy]methyl}-4-methylpyridin-2-amine |
| OpenEye OEToolkits | 1.7.6 | 6-[[3-(3-azanylpropoxy)phenoxy]methyl]-4-methyl-pyridin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O(c2cccc(OCc1nc(N)cc(c1)C)c2)CCCN |
| InChI | InChI | 1.03 | InChI=1S/C16H21N3O2/c1-12-8-13(19-16(18)9-12)11-21-15-5-2-4-14(10-15)20-7-3-6-17/h2,4-5,8-10H,3,6-7,11,17H2,1H3,(H2,18,19) |
| InChIKey | InChI | 1.03 | USONDHXIUNXLQT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Cc1cc(N)nc(COc2cccc(OCCCN)c2)c1 |
| SMILES | CACTVS | 3.370 | Cc1cc(N)nc(COc2cccc(OCCCN)c2)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1cc(nc(c1)N)COc2cccc(c2)OCCCN |
| SMILES | OpenEye OEToolkits | 1.7.6 | Cc1cc(nc(c1)N)COc2cccc(c2)OCCCN |
