OUG
Summary
| Name: | 7-[3-(aminomethyl)phenyl]-4-methylquinolin-2-amine |
| Formula: | C17 H17 N3 |
| Formal charge: | 0 |
| Formula weight: | 263.337 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 7-[3-(aminomethyl)phenyl]-4-methylquinolin-2-amine |
| OpenEye OEToolkits | 2.0.7 | 7-[3-(aminomethyl)phenyl]-4-methyl-quinolin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c31c(c(C)cc(N)n1)ccc(c2cc(ccc2)CN)c3 |
| InChI | InChI | 1.03 | InChI=1S/C17H17N3/c1-11-7-17(19)20-16-9-14(5-6-15(11)16)13-4-2-3-12(8-13)10-18/h2-9H,10,18H2,1H3,(H2,19,20) |
| InChIKey | InChI | 1.03 | IYZDGTYWMCMPLR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(N)nc2cc(ccc12)c3cccc(CN)c3 |
| SMILES | CACTVS | 3.385 | Cc1cc(N)nc2cc(ccc12)c3cccc(CN)c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(nc2c1ccc(c2)c3cccc(c3)CN)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(nc2c1ccc(c2)c3cccc(c3)CN)N |
