About N-[(Z)-cyclohexylmethylideneamino]octanamide
N-[(Z)-cyclohexylmethylideneamino]octanamide (PubChem CID 6069457) has the molecular formula C15H28N2O
and a molecular weight of 252.40 g/mol. Its IUPAC name is N-[(Z)-cyclohexylmethylideneamino]octanamide.
Molecular Properties
| Compound Name | N-[(Z)-cyclohexylmethylideneamino]octanamide |
| PubChem CID | 6069457 |
| Molecular Formula | C15H28N2O |
| Molecular Weight | 252.40 g/mol |
| Exact Mass | 252.22 |
| IUPAC Name | N-[(Z)-cyclohexylmethylideneamino]octanamide |
| SMILES | CCCCCCCC(=O)N/N=C\C1CCCCC1 |
| InChI | InChI=1S/C15H28N2O/c1-2-3-4-5-9-12-15(18)17-16-13-14-10-7-6-8-11-14/h13-14H,2-12H2,1H3,(H,17,18)/b16-13- |
| InChIKey | ZUJFCIBDBCMLIN-SSZFMOIBSA-N |
| XLogP | 4.03 |
| TPSA | 41.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 252.40 |
| LogP ≤ 5 | 4.03 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[(Z)-cyclohexylmethylideneamino]octanamide?
The IUPAC name of N-[(Z)-cyclohexylmethylideneamino]octanamide (CID 6069457) is N-[(Z)-cyclohexylmethylideneamino]octanamide.
What is the SMILES notation for N-[(Z)-cyclohexylmethylideneamino]octanamide?
The canonical SMILES for N-[(Z)-cyclohexylmethylideneamino]octanamide is CCCCCCCC(=O)N/N=C\C1CCCCC1.
What is the InChIKey of N-[(Z)-cyclohexylmethylideneamino]octanamide?
The InChIKey is ZUJFCIBDBCMLIN-SSZFMOIBSA-N. The full InChI is InChI=1S/C15H28N2O/c1-2-3-4-5-9-12-15(18)17-16-13-14-10-7-6-8-11-14/h13-14H,2-12H2,1H3,(H,17,18)/b16-13-.
What are the key properties of N-[(Z)-cyclohexylmethylideneamino]octanamide?
N-[(Z)-cyclohexylmethylideneamino]octanamide has a molecular weight of 252.40 g/mol, XLogP of 4.03, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-cyclohexylmethylideneamino]octanamide is sourced from PubChem (CID 6069457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).