About 1-methyl-2-azaspiro[5.5]undecan-1-ol
1-methyl-2-azaspiro[5.5]undecan-1-ol (PubChem CID 140662959) has the molecular formula C11H21NO
and a molecular weight of 183.29 g/mol. Its IUPAC name is 1-methyl-2-azaspiro[5.5]undecan-1-ol.
Molecular Properties
| Compound Name | 1-methyl-2-azaspiro[5.5]undecan-1-ol |
| PubChem CID | 140662959 |
| Molecular Formula | C11H21NO |
| Molecular Weight | 183.29 g/mol |
| Exact Mass | 183.16 |
| IUPAC Name | 1-methyl-2-azaspiro[5.5]undecan-1-ol |
| SMILES | CC1(O)NCCCC12CCCCC2 |
| InChI | InChI=1S/C11H21NO/c1-10(13)11(8-5-9-12-10)6-3-2-4-7-11/h12-13H,2-9H2,1H3 |
| InChIKey | SKWDSRKPOLKNRY-UHFFFAOYSA-N |
| XLogP | 2.03 |
| TPSA | 32.26 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 183.29 |
| LogP ≤ 5 | 2.03 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-methyl-2-azaspiro[5.5]undecan-1-ol?
The IUPAC name of 1-methyl-2-azaspiro[5.5]undecan-1-ol (CID 140662959) is 1-methyl-2-azaspiro[5.5]undecan-1-ol.
What is the SMILES notation for 1-methyl-2-azaspiro[5.5]undecan-1-ol?
The canonical SMILES for 1-methyl-2-azaspiro[5.5]undecan-1-ol is CC1(O)NCCCC12CCCCC2.
What is the InChIKey of 1-methyl-2-azaspiro[5.5]undecan-1-ol?
The InChIKey is SKWDSRKPOLKNRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(13)11(8-5-9-12-10)6-3-2-4-7-11/h12-13H,2-9H2,1H3.
What are the key properties of 1-methyl-2-azaspiro[5.5]undecan-1-ol?
1-methyl-2-azaspiro[5.5]undecan-1-ol has a molecular weight of 183.29 g/mol, XLogP of 2.03, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-azaspiro[5.5]undecan-1-ol is sourced from PubChem (CID 140662959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).