About N-methyl-N-nonadecylhydroxylamine
N-methyl-N-nonadecylhydroxylamine (PubChem CID 87390757) has the molecular formula C20H43NO
and a molecular weight of 313.57 g/mol. Its IUPAC name is N-methyl-N-nonadecylhydroxylamine.
Molecular Properties
| Compound Name | N-methyl-N-nonadecylhydroxylamine |
| PubChem CID | 87390757 |
| Molecular Formula | C20H43NO |
| Molecular Weight | 313.57 g/mol |
| Exact Mass | 313.33 |
| IUPAC Name | N-methyl-N-nonadecylhydroxylamine |
| SMILES | CCCCCCCCCCCCCCCCCCCN(C)O |
| InChI | InChI=1S/C20H43NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)22/h22H,3-20H2,1-2H3 |
| InChIKey | FVCLHFNFVZNSKX-UHFFFAOYSA-N |
| XLogP | 6.96 |
| TPSA | 23.47 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 313.57 |
| LogP ≤ 5 | 6.96 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', '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 N-methyl-N-nonadecylhydroxylamine?
The IUPAC name of N-methyl-N-nonadecylhydroxylamine (CID 87390757) is N-methyl-N-nonadecylhydroxylamine.
What is the SMILES notation for N-methyl-N-nonadecylhydroxylamine?
The canonical SMILES for N-methyl-N-nonadecylhydroxylamine is CCCCCCCCCCCCCCCCCCCN(C)O.
What is the InChIKey of N-methyl-N-nonadecylhydroxylamine?
The InChIKey is FVCLHFNFVZNSKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H43NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)22/h22H,3-20H2,1-2H3.
What are the key properties of N-methyl-N-nonadecylhydroxylamine?
N-methyl-N-nonadecylhydroxylamine has a molecular weight of 313.57 g/mol, XLogP of 6.96, 18 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-nonadecylhydroxylamine is sourced from PubChem (CID 87390757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).