About 1-amino-2-(diethylsulfamoylamino)propane
1-amino-2-(diethylsulfamoylamino)propane (PubChem CID 61123970) has the molecular formula C7H19N3O2S
and a molecular weight of 209.31 g/mol. Its IUPAC name is 1-amino-2-(diethylsulfamoylamino)propane.
Molecular Properties
| Compound Name | 1-amino-2-(diethylsulfamoylamino)propane |
| PubChem CID | 61123970 |
| Molecular Formula | C7H19N3O2S |
| Molecular Weight | 209.31 g/mol |
| Exact Mass | 209.12 |
| IUPAC Name | 1-amino-2-(diethylsulfamoylamino)propane |
| SMILES | CCN(CC)S(=O)(=O)NC(C)CN |
| InChI | InChI=1S/C7H19N3O2S/c1-4-10(5-2)13(11,12)9-7(3)6-8/h7,9H,4-6,8H2,1-3H3 |
| InChIKey | RUCLXHYTBCCAKW-UHFFFAOYSA-N |
| XLogP | -0.49 |
| TPSA | 75.43 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 209.31 |
| LogP ≤ 5 | -0.49 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-amino-2-(diethylsulfamoylamino)propane?
The IUPAC name of 1-amino-2-(diethylsulfamoylamino)propane (CID 61123970) is 1-amino-2-(diethylsulfamoylamino)propane.
What is the SMILES notation for 1-amino-2-(diethylsulfamoylamino)propane?
The canonical SMILES for 1-amino-2-(diethylsulfamoylamino)propane is CCN(CC)S(=O)(=O)NC(C)CN.
What is the InChIKey of 1-amino-2-(diethylsulfamoylamino)propane?
The InChIKey is RUCLXHYTBCCAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19N3O2S/c1-4-10(5-2)13(11,12)9-7(3)6-8/h7,9H,4-6,8H2,1-3H3.
What are the key properties of 1-amino-2-(diethylsulfamoylamino)propane?
1-amino-2-(diethylsulfamoylamino)propane has a molecular weight of 209.31 g/mol, XLogP of -0.49, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-(diethylsulfamoylamino)propane is sourced from PubChem (CID 61123970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).