AVR
Summary
| Name: | (2R)-2-amino-1-[2-(1-methylethyl)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one |
| Synonyms: | (R)-2-amino-1-(2-isopropylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one |
| Formula: | C13 H17 N3 O |
| Formal charge: | 0 |
| Formula weight: | 231.294 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 11.02 | (2R)-2-amino-1-[2-(propan-2-yl)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one |
| OpenEye OEToolkits | 1.6.1 | (2R)-2-azanyl-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | O=C(c1c2ccccn2nc1C(C)C)C(N)C |
| SMILES_CANONICAL | CACTVS | 3.352 | CC(C)c1nn2ccccc2c1C(=O)[C@@H](C)N |
| SMILES | CACTVS | 3.352 | CC(C)c1nn2ccccc2c1C(=O)[CH](C)N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C[C@H](C(=O)c1c2ccccn2nc1C(C)C)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | CC(C)c1c(c2ccccn2n1)C(=O)C(C)N |
| InChI | InChI | 1.03 | InChI=1S/C13H17N3O/c1-8(2)12-11(13(17)9(3)14)10-6-4-5-7-16(10)15-12/h4-9H,14H2,1-3H3/t9-/m1/s1 |
| InChIKey | InChI | 1.03 | JLKPIOQFGACSJO-SECBINFHSA-N |
