About 3-dimethylphosphanyl-N,N-dimethylpropan-1-amine
3-dimethylphosphanyl-N,N-dimethylpropan-1-amine (PubChem CID 10920659) has the molecular formula C7H18NP
and a molecular weight of 147.20 g/mol. Its IUPAC name is 3-dimethylphosphanyl-N,N-dimethylpropan-1-amine.
Molecular Properties
| Compound Name | 3-dimethylphosphanyl-N,N-dimethylpropan-1-amine |
| PubChem CID | 10920659 |
| Molecular Formula | C7H18NP |
| Molecular Weight | 147.20 g/mol |
| Exact Mass | 147.12 |
| IUPAC Name | 3-dimethylphosphanyl-N,N-dimethylpropan-1-amine |
| SMILES | CN(C)CCCP(C)C |
| InChI | InChI=1S/C7H18NP/c1-8(2)6-5-7-9(3)4/h5-7H2,1-4H3 |
| InChIKey | SBHUNYHCPLYDGB-UHFFFAOYSA-N |
| XLogP | 1.68 |
| TPSA | 3.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 147.20 |
| LogP ≤ 5 | 1.68 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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-dimethylphosphanyl-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-dimethylphosphanyl-N,N-dimethylpropan-1-amine (CID 10920659) is 3-dimethylphosphanyl-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-dimethylphosphanyl-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-dimethylphosphanyl-N,N-dimethylpropan-1-amine is CN(C)CCCP(C)C.
What is the InChIKey of 3-dimethylphosphanyl-N,N-dimethylpropan-1-amine?
The InChIKey is SBHUNYHCPLYDGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18NP/c1-8(2)6-5-7-9(3)4/h5-7H2,1-4H3.
What are the key properties of 3-dimethylphosphanyl-N,N-dimethylpropan-1-amine?
3-dimethylphosphanyl-N,N-dimethylpropan-1-amine has a molecular weight of 147.20 g/mol, XLogP of 1.68, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dimethylphosphanyl-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 10920659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).