2D structurePubChem CID 413888
Identidad
2-Aminocyclohexanone
No indicado · C6H11NO
01Identidad
| Lazychem ID | LC-108076 |
|---|---|
| CAS RN | No indicado |
| PubChem CID | 413888 |
| Molecular formula | C6H11NO |
| Molecular weight | 113.16 g/mol |
| IUPAC name | 2-aminocyclohexan-1-one |
| InChIKey | KMLPEYHLAKSCGX-UHFFFAOYSA-N |
02Estructura y estereoquímica
2D structurePubChem CID 413888
The parsed structure contains 1 ring, includes aliphatic carbon. These statements are calculated from the published structure string.
| Defined stereocentres | 0 |
|---|---|
| Ring count | 1 |
| Secondary amines | 0 |
| Tertiary amines | 0 |
| SMILES | C1CCC(=O)C(C1)N |
|---|---|
| InChI | No indicado |
03Stereochemistry
The published structure contains 0 defined and 1 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.
Defined centres0Structure assigned
Unassigned centres1Structure unspecified
Assignment statusUnassignedExact published identity
Tetrahedral upper bound≤ 2Before symmetry reduction
Published same-connectivity configurations
1 recordThese records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.
No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.
Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.
04Estado en India
Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.
05Nombres y relaciones
API y fármaco de origen
No indicado
Nombres y relaciones
06Fuentes
- S01PubChem CID 413888
Structure and machine-readable chemical identifiers.