About 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane
6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane (PubChem CID 130636839) has the molecular formula C11H18ClN
and a molecular weight of 199.72 g/mol. Its IUPAC name is 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane.
Molecular Properties
| Compound Name | 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane |
| PubChem CID | 130636839 |
| Molecular Formula | C11H18ClN |
| Molecular Weight | 199.72 g/mol |
| Exact Mass | 199.11 |
| IUPAC Name | 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane |
| SMILES | C=C(Cl)CN1CCCC2(CCC2)C1 |
| InChI | InChI=1S/C11H18ClN/c1-10(12)8-13-7-3-6-11(9-13)4-2-5-11/h1-9H2 |
| InChIKey | MGNWVDPVJQPNDF-UHFFFAOYSA-N |
| XLogP | 3.01 |
| TPSA | 3.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 199.72 |
| LogP ≤ 5 | 3.01 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane?
The IUPAC name of 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane (CID 130636839) is 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane.
What is the SMILES notation for 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane?
The canonical SMILES for 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane is C=C(Cl)CN1CCCC2(CCC2)C1.
What is the InChIKey of 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane?
The InChIKey is MGNWVDPVJQPNDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18ClN/c1-10(12)8-13-7-3-6-11(9-13)4-2-5-11/h1-9H2.
What are the key properties of 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane?
6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane has a molecular weight of 199.72 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chloroprop-2-enyl)-6-azaspiro[3.5]nonane is sourced from PubChem (CID 130636839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).