About N-(cyclodecen-1-yl)cyclodecanimine
N-(cyclodecen-1-yl)cyclodecanimine (PubChem CID 57204694) has the molecular formula C20H35N
and a molecular weight of 289.51 g/mol. Its IUPAC name is N-(cyclodecen-1-yl)cyclodecanimine.
Molecular Properties
| Compound Name | N-(cyclodecen-1-yl)cyclodecanimine |
| PubChem CID | 57204694 |
| Molecular Formula | C20H35N |
| Molecular Weight | 289.51 g/mol |
| Exact Mass | 289.28 |
| IUPAC Name | N-(cyclodecen-1-yl)cyclodecanimine |
| SMILES | C1=C(N=C2CCCCCCCCC2)CCCCCCCC1 |
| InChI | InChI=1S/C20H35N/c1-3-7-11-15-19(16-12-8-4-1)21-20-17-13-9-5-2-6-10-14-18-20/h15H,1-14,16-18H2 |
| InChIKey | OUKQQKCUMAXAPZ-UHFFFAOYSA-N |
| XLogP | 6.97 |
| TPSA | 12.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 289.51 |
| LogP ≤ 5 | 6.97 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-(cyclodecen-1-yl)cyclodecanimine?
The IUPAC name of N-(cyclodecen-1-yl)cyclodecanimine (CID 57204694) is N-(cyclodecen-1-yl)cyclodecanimine.
What is the SMILES notation for N-(cyclodecen-1-yl)cyclodecanimine?
The canonical SMILES for N-(cyclodecen-1-yl)cyclodecanimine is C1=C(N=C2CCCCCCCCC2)CCCCCCCC1.
What is the InChIKey of N-(cyclodecen-1-yl)cyclodecanimine?
The InChIKey is OUKQQKCUMAXAPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H35N/c1-3-7-11-15-19(16-12-8-4-1)21-20-17-13-9-5-2-6-10-14-18-20/h15H,1-14,16-18H2.
What are the key properties of N-(cyclodecen-1-yl)cyclodecanimine?
N-(cyclodecen-1-yl)cyclodecanimine has a molecular weight of 289.51 g/mol, XLogP of 6.97, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclodecen-1-yl)cyclodecanimine is sourced from PubChem (CID 57204694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).