About 10-amino-4-methyldec-6-en-3-ol
10-amino-4-methyldec-6-en-3-ol (PubChem CID 91598548) has the molecular formula C11H23NO
and a molecular weight of 185.31 g/mol. Its IUPAC name is 10-amino-4-methyldec-6-en-3-ol.
Molecular Properties
| Compound Name | 10-amino-4-methyldec-6-en-3-ol |
| PubChem CID | 91598548 |
| Molecular Formula | C11H23NO |
| Molecular Weight | 185.31 g/mol |
| Exact Mass | 185.18 |
| IUPAC Name | 10-amino-4-methyldec-6-en-3-ol |
| SMILES | CCC(O)C(C)CC=CCCCN |
| InChI | InChI=1S/C11H23NO/c1-3-11(13)10(2)8-6-4-5-7-9-12/h4,6,10-11,13H,3,5,7-9,12H2,1-2H3 |
| InChIKey | PRZXXTJCZAVXMV-UHFFFAOYSA-N |
| XLogP | 2.08 |
| TPSA | 46.25 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 185.31 |
| LogP ≤ 5 | 2.08 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 10-amino-4-methyldec-6-en-3-ol?
The IUPAC name of 10-amino-4-methyldec-6-en-3-ol (CID 91598548) is 10-amino-4-methyldec-6-en-3-ol.
What is the SMILES notation for 10-amino-4-methyldec-6-en-3-ol?
The canonical SMILES for 10-amino-4-methyldec-6-en-3-ol is CCC(O)C(C)CC=CCCCN.
What is the InChIKey of 10-amino-4-methyldec-6-en-3-ol?
The InChIKey is PRZXXTJCZAVXMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-11(13)10(2)8-6-4-5-7-9-12/h4,6,10-11,13H,3,5,7-9,12H2,1-2H3.
What are the key properties of 10-amino-4-methyldec-6-en-3-ol?
10-amino-4-methyldec-6-en-3-ol has a molecular weight of 185.31 g/mol, XLogP of 2.08, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-amino-4-methyldec-6-en-3-ol is sourced from PubChem (CID 91598548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).