About 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid
5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid (PubChem CID 89052113) has the molecular formula C7H8N2O2S
and a molecular weight of 184.22 g/mol. Its IUPAC name is 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid.
Molecular Properties
| Compound Name | 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid |
| PubChem CID | 89052113 |
| Molecular Formula | C7H8N2O2S |
| Molecular Weight | 184.22 g/mol |
| Exact Mass | 184.03 |
| IUPAC Name | 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid |
| SMILES | O=C(O)Nc1nc2c(s1)CCC2 |
| InChI | InChI=1S/C7H8N2O2S/c10-7(11)9-6-8-4-2-1-3-5(4)12-6/h1-3H2,(H,8,9)(H,10,11) |
| InChIKey | SDSBTALDWBSWND-UHFFFAOYSA-N |
| XLogP | 1.72 |
| TPSA | 62.22 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 184.22 |
| LogP ≤ 5 | 1.72 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid?
The IUPAC name of 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid (CID 89052113) is 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid.
What is the SMILES notation for 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid?
The canonical SMILES for 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid is O=C(O)Nc1nc2c(s1)CCC2.
What is the InChIKey of 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid?
The InChIKey is SDSBTALDWBSWND-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2S/c10-7(11)9-6-8-4-2-1-3-5(4)12-6/h1-3H2,(H,8,9)(H,10,11).
What are the key properties of 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid?
5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid has a molecular weight of 184.22 g/mol, XLogP of 1.72, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylcarbamic acid is sourced from PubChem (CID 89052113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).