About 1-propoxydecan-2-ylhydrazine
1-propoxydecan-2-ylhydrazine (PubChem CID 105209959) has the molecular formula C13H30N2O
and a molecular weight of 230.40 g/mol. Its IUPAC name is 1-propoxydecan-2-ylhydrazine.
Molecular Properties
| Compound Name | 1-propoxydecan-2-ylhydrazine |
| PubChem CID | 105209959 |
| Molecular Formula | C13H30N2O |
| Molecular Weight | 230.40 g/mol |
| Exact Mass | 230.24 |
| IUPAC Name | 1-propoxydecan-2-ylhydrazine |
| SMILES | CCCCCCCCC(COCCC)NN |
| InChI | InChI=1S/C13H30N2O/c1-3-5-6-7-8-9-10-13(15-14)12-16-11-4-2/h13,15H,3-12,14H2,1-2H3 |
| InChIKey | UEDXYTVLAQBRPC-UHFFFAOYSA-N |
| XLogP | 3.00 |
| TPSA | 47.28 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 230.40 |
| LogP ≤ 5 | 3.00 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', '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 1-propoxydecan-2-ylhydrazine?
The IUPAC name of 1-propoxydecan-2-ylhydrazine (CID 105209959) is 1-propoxydecan-2-ylhydrazine.
What is the SMILES notation for 1-propoxydecan-2-ylhydrazine?
The canonical SMILES for 1-propoxydecan-2-ylhydrazine is CCCCCCCCC(COCCC)NN.
What is the InChIKey of 1-propoxydecan-2-ylhydrazine?
The InChIKey is UEDXYTVLAQBRPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O/c1-3-5-6-7-8-9-10-13(15-14)12-16-11-4-2/h13,15H,3-12,14H2,1-2H3.
What are the key properties of 1-propoxydecan-2-ylhydrazine?
1-propoxydecan-2-ylhydrazine has a molecular weight of 230.40 g/mol, XLogP of 3.00, 12 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propoxydecan-2-ylhydrazine is sourced from PubChem (CID 105209959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).