About (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine
(3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine (PubChem CID 167503835) has the molecular formula C11H21FN2
and a molecular weight of 200.30 g/mol. Its IUPAC name is (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine.
Molecular Properties
| Compound Name | (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine |
| PubChem CID | 167503835 |
| Molecular Formula | C11H21FN2 |
| Molecular Weight | 200.30 g/mol |
| Exact Mass | 200.17 |
| IUPAC Name | (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine |
| SMILES | CN1CC[C@@H](N(CCF)C2CCC2)C1 |
| InChI | InChI=1S/C11H21FN2/c1-13-7-5-11(9-13)14(8-6-12)10-3-2-4-10/h10-11H,2-9H2,1H3/t11-/m1/s1 |
| InChIKey | NBNXHVJEMJDJQS-LLVKDONJSA-N |
| XLogP | 1.51 |
| TPSA | 6.48 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 200.30 |
| LogP ≤ 5 | 1.51 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine?
The IUPAC name of (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine (CID 167503835) is (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine.
What is the SMILES notation for (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine?
The canonical SMILES for (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine is CN1CC[C@@H](N(CCF)C2CCC2)C1.
What is the InChIKey of (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine?
The InChIKey is NBNXHVJEMJDJQS-LLVKDONJSA-N. The full InChI is InChI=1S/C11H21FN2/c1-13-7-5-11(9-13)14(8-6-12)10-3-2-4-10/h10-11H,2-9H2,1H3/t11-/m1/s1.
What are the key properties of (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine?
(3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine has a molecular weight of 200.30 g/mol, XLogP of 1.51, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-cyclobutyl-N-(2-fluoroethyl)-1-methylpyrrolidin-3-amine is sourced from PubChem (CID 167503835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).