About N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide
N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide (PubChem CID 11119059) has the molecular formula C14H21NO2S
and a molecular weight of 267.39 g/mol. Its IUPAC name is N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide.
Molecular Properties
| Compound Name | N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide |
| PubChem CID | 11119059 |
| Molecular Formula | C14H21NO2S |
| Molecular Weight | 267.39 g/mol |
| Exact Mass | 267.13 |
| IUPAC Name | N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide |
| SMILES | CC(C)S(=O)(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 |
| InChI | InChI=1S/C14H21NO2S/c1-11(2)18(16,17)15-14-10-6-9-13(14)12-7-4-3-5-8-12/h3-5,7-8,11,13-15H,6,9-10H2,1-2H3/t13-,14-/m1/s1 |
| InChIKey | FKSYMILUYVSIDD-ZIAGYGMSSA-N |
| XLogP | 2.65 |
| TPSA | 46.17 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 267.39 |
| LogP ≤ 5 | 2.65 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide?
The IUPAC name of N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide (CID 11119059) is N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide.
What is the SMILES notation for N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide?
The canonical SMILES for N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide is CC(C)S(=O)(=O)N[C@@H]1CCC[C@@H]1c1ccccc1.
What is the InChIKey of N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide?
The InChIKey is FKSYMILUYVSIDD-ZIAGYGMSSA-N. The full InChI is InChI=1S/C14H21NO2S/c1-11(2)18(16,17)15-14-10-6-9-13(14)12-7-4-3-5-8-12/h3-5,7-8,11,13-15H,6,9-10H2,1-2H3/t13-,14-/m1/s1.
What are the key properties of N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide?
N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide has a molecular weight of 267.39 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-phenylcyclopentyl]propane-2-sulfonamide is sourced from PubChem (CID 11119059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).