About 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine
2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine (PubChem CID 103923918) has the molecular formula C13H25NO
and a molecular weight of 211.35 g/mol. Its IUPAC name is 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine.
Molecular Properties
| Compound Name | 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine |
| PubChem CID | 103923918 |
| Molecular Formula | C13H25NO |
| Molecular Weight | 211.35 g/mol |
| Exact Mass | 211.19 |
| IUPAC Name | 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine |
| SMILES | CCC(CC)CNC1CCOC1C1CC1 |
| InChI | InChI=1S/C13H25NO/c1-3-10(4-2)9-14-12-7-8-15-13(12)11-5-6-11/h10-14H,3-9H2,1-2H3 |
| InChIKey | LTNBBTGWGRKAPQ-UHFFFAOYSA-N |
| XLogP | 2.58 |
| TPSA | 21.26 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 211.35 |
| LogP ≤ 5 | 2.58 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine?
The IUPAC name of 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine (CID 103923918) is 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine.
What is the SMILES notation for 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine?
The canonical SMILES for 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine is CCC(CC)CNC1CCOC1C1CC1.
What is the InChIKey of 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine?
The InChIKey is LTNBBTGWGRKAPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-3-10(4-2)9-14-12-7-8-15-13(12)11-5-6-11/h10-14H,3-9H2,1-2H3.
What are the key properties of 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine?
2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine has a molecular weight of 211.35 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(2-ethylbutyl)oxolan-3-amine is sourced from PubChem (CID 103923918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).