About cyclopentyl N-(oxetan-3-yl)carbamate
cyclopentyl N-(oxetan-3-yl)carbamate (PubChem CID 129131220) has the molecular formula C9H15NO3
and a molecular weight of 185.22 g/mol. Its IUPAC name is cyclopentyl N-(oxetan-3-yl)carbamate.
Molecular Properties
| Compound Name | cyclopentyl N-(oxetan-3-yl)carbamate |
| PubChem CID | 129131220 |
| Molecular Formula | C9H15NO3 |
| Molecular Weight | 185.22 g/mol |
| Exact Mass | 185.11 |
| IUPAC Name | cyclopentyl N-(oxetan-3-yl)carbamate |
| SMILES | O=C(NC1COC1)OC1CCCC1 |
| InChI | InChI=1S/C9H15NO3/c11-9(10-7-5-12-6-7)13-8-3-1-2-4-8/h7-8H,1-6H2,(H,10,11) |
| InChIKey | RENPFTXEFDNSSL-UHFFFAOYSA-N |
| XLogP | 1.05 |
| TPSA | 47.56 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 185.22 |
| LogP ≤ 5 | 1.05 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of cyclopentyl N-(oxetan-3-yl)carbamate?
The IUPAC name of cyclopentyl N-(oxetan-3-yl)carbamate (CID 129131220) is cyclopentyl N-(oxetan-3-yl)carbamate.
What is the SMILES notation for cyclopentyl N-(oxetan-3-yl)carbamate?
The canonical SMILES for cyclopentyl N-(oxetan-3-yl)carbamate is O=C(NC1COC1)OC1CCCC1.
What is the InChIKey of cyclopentyl N-(oxetan-3-yl)carbamate?
The InChIKey is RENPFTXEFDNSSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO3/c11-9(10-7-5-12-6-7)13-8-3-1-2-4-8/h7-8H,1-6H2,(H,10,11).
What are the key properties of cyclopentyl N-(oxetan-3-yl)carbamate?
cyclopentyl N-(oxetan-3-yl)carbamate has a molecular weight of 185.22 g/mol, XLogP of 1.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl N-(oxetan-3-yl)carbamate is sourced from PubChem (CID 129131220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).