About 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine
1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine (PubChem CID 115244573) has the molecular formula C11H23N3
and a molecular weight of 197.33 g/mol. Its IUPAC name is 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine.
Molecular Properties
| Compound Name | 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine |
| PubChem CID | 115244573 |
| Molecular Formula | C11H23N3 |
| Molecular Weight | 197.33 g/mol |
| Exact Mass | 197.19 |
| IUPAC Name | 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine |
| SMILES | CNCC1(CNC2CCN(C)C2)CC1 |
| InChI | InChI=1S/C11H23N3/c1-12-8-11(4-5-11)9-13-10-3-6-14(2)7-10/h10,12-13H,3-9H2,1-2H3 |
| InChIKey | SZYBJMOSDWIGPW-UHFFFAOYSA-N |
| XLogP | 0.28 |
| TPSA | 27.30 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 197.33 |
| LogP ≤ 5 | 0.28 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine?
The IUPAC name of 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine (CID 115244573) is 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine.
What is the SMILES notation for 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine?
The canonical SMILES for 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine is CNCC1(CNC2CCN(C)C2)CC1.
What is the InChIKey of 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine?
The InChIKey is SZYBJMOSDWIGPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-12-8-11(4-5-11)9-13-10-3-6-14(2)7-10/h10,12-13H,3-9H2,1-2H3.
What are the key properties of 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine?
1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine has a molecular weight of 197.33 g/mol, XLogP of 0.28, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine is sourced from PubChem (CID 115244573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).