About 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium)
3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium) (PubChem CID 159857454) has the molecular formula C8H23N2O2PY2
and a molecular weight of 388.07 g/mol. Its IUPAC name is 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium).
Molecular Properties
| Compound Name | 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium) |
| PubChem CID | 159857454 |
| Molecular Formula | C8H23N2O2PY2 |
| Molecular Weight | 388.07 g/mol |
| Exact Mass | 387.96 |
| IUPAC Name | 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium) |
| SMILES | CN(C)CCCO.CNC.CP=O.[Y].[Y] |
| InChI | InChI=1S/C5H13NO.C2H7N.CH3OP.2Y/c1-6(2)4-3-5-7;2*1-3-2;;/h7H,3-5H2,1-2H3;3H,1-2H3;1H3;; |
| InChIKey | NQRZLXABWXSMSF-UHFFFAOYSA-N |
| XLogP | 0.67 |
| TPSA | 52.57 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 388.07 |
| LogP ≤ 5 | 0.67 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium)?
The IUPAC name of 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium) (CID 159857454) is 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium).
What is the SMILES notation for 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium)?
The canonical SMILES for 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium) is CN(C)CCCO.CNC.CP=O.[Y].[Y].
What is the InChIKey of 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium)?
The InChIKey is NQRZLXABWXSMSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO.C2H7N.CH3OP.2Y/c1-6(2)4-3-5-7;2*1-3-2;;/h7H,3-5H2,1-2H3;3H,1-2H3;1H3;;.
What are the key properties of 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium)?
3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium) has a molecular weight of 388.07 g/mol, XLogP of 0.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)propan-1-ol;N-methylmethanamine;phosphorosomethane;bis(yttrium) is sourced from PubChem (CID 159857454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).