About [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane
[2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane (PubChem CID 120717956) has the molecular formula C10H23N3O3S
and a molecular weight of 265.38 g/mol. Its IUPAC name is [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane.
Molecular Properties
| Compound Name | [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane |
| PubChem CID | 120717956 |
| Molecular Formula | C10H23N3O3S |
| Molecular Weight | 265.38 g/mol |
| Exact Mass | 265.15 |
| IUPAC Name | [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane |
| SMILES | COCCNCCNS(=O)(=O)N(C)CC1CC1 |
| InChI | InChI=1S/C10H23N3O3S/c1-13(9-10-3-4-10)17(14,15)12-6-5-11-7-8-16-2/h10-12H,3-9H2,1-2H3 |
| InChIKey | ZXBMGPBUXUGDSX-UHFFFAOYSA-N |
| XLogP | -0.60 |
| TPSA | 70.67 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 265.38 |
| LogP ≤ 5 | -0.60 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane?
The IUPAC name of [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane (CID 120717956) is [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane.
What is the SMILES notation for [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane?
The canonical SMILES for [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane is COCCNCCNS(=O)(=O)N(C)CC1CC1.
What is the InChIKey of [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane?
The InChIKey is ZXBMGPBUXUGDSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O3S/c1-13(9-10-3-4-10)17(14,15)12-6-5-11-7-8-16-2/h10-12H,3-9H2,1-2H3.
What are the key properties of [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane?
[2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane has a molecular weight of 265.38 g/mol, XLogP of -0.60, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxyethylamino)ethylsulfamoyl-methylamino]methylcyclopropane is sourced from PubChem (CID 120717956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).