About 2-propyl-1,2-thiazolidine 1,1-dioxide
2-propyl-1,2-thiazolidine 1,1-dioxide (PubChem CID 10820899) has the molecular formula C6H13NO2S
and a molecular weight of 163.24 g/mol. Its IUPAC name is 2-propyl-1,2-thiazolidine 1,1-dioxide.
Molecular Properties
| Compound Name | 2-propyl-1,2-thiazolidine 1,1-dioxide |
|---|
| PubChem CID | 10820899 |
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| Molecular Formula | C6H13NO2S |
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| Molecular Weight | 163.24 g/mol |
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| Exact Mass | 163.07 |
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| IUPAC Name | 2-propyl-1,2-thiazolidine 1,1-dioxide |
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| SMILES | CCCN1CCCS1(=O)=O |
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| InChI | InChI=1S/C6H13NO2S/c1-2-4-7-5-3-6-10(7,8)9/h2-6H2,1H3 |
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| InChIKey | MEWOOKCAVBNRHE-UHFFFAOYSA-N |
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| XLogP | 0.43 |
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| TPSA | 37.38 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 2 |
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| Rotatable Bonds | 2 |
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| Heavy Atoms | 10 |
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| Complexity | — |
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Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|
| MW ≤ 500 | 163.24 |
| LogP ≤ 5 | 0.43 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-propyl-1,2-thiazolidine 1,1-dioxide?
The IUPAC name of 2-propyl-1,2-thiazolidine 1,1-dioxide (CID 10820899) is 2-propyl-1,2-thiazolidine 1,1-dioxide.
What is the SMILES notation for 2-propyl-1,2-thiazolidine 1,1-dioxide?
The canonical SMILES for 2-propyl-1,2-thiazolidine 1,1-dioxide is CCCN1CCCS1(=O)=O.
What is the InChIKey of 2-propyl-1,2-thiazolidine 1,1-dioxide?
The InChIKey is MEWOOKCAVBNRHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2S/c1-2-4-7-5-3-6-10(7,8)9/h2-6H2,1H3.
What are the key properties of 2-propyl-1,2-thiazolidine 1,1-dioxide?
2-propyl-1,2-thiazolidine 1,1-dioxide has a molecular weight of 163.24 g/mol, XLogP of 0.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-1,2-thiazolidine 1,1-dioxide is sourced from PubChem (CID 10820899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).