About N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide
N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide (PubChem CID 114386511) has the molecular formula C9H18N2O3S
and a molecular weight of 234.32 g/mol. Its IUPAC name is N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide.
Molecular Properties
| Compound Name | N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide |
| PubChem CID | 114386511 |
| Molecular Formula | C9H18N2O3S |
| Molecular Weight | 234.32 g/mol |
| Exact Mass | 234.10 |
| IUPAC Name | N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide |
| SMILES | O=S(=O)(NC1CC1)N1CCC(CCO)C1 |
| InChI | InChI=1S/C9H18N2O3S/c12-6-4-8-3-5-11(7-8)15(13,14)10-9-1-2-9/h8-10,12H,1-7H2 |
| InChIKey | USTBNIFGTCGEHH-UHFFFAOYSA-N |
| XLogP | -0.31 |
| TPSA | 69.64 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 234.32 |
| LogP ≤ 5 | -0.31 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide (CID 114386511) is N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide is O=S(=O)(NC1CC1)N1CCC(CCO)C1.
What is the InChIKey of N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide?
The InChIKey is USTBNIFGTCGEHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3S/c12-6-4-8-3-5-11(7-8)15(13,14)10-9-1-2-9/h8-10,12H,1-7H2.
What are the key properties of N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide?
N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide has a molecular weight of 234.32 g/mol, XLogP of -0.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(2-hydroxyethyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 114386511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).