About 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine
1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine (PubChem CID 131107734) has the molecular formula C11H22N2
and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine.
Molecular Properties
| Compound Name | 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine |
| PubChem CID | 131107734 |
| Molecular Formula | C11H22N2 |
| Molecular Weight | 182.31 g/mol |
| Exact Mass | 182.18 |
| IUPAC Name | 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine |
| SMILES | CC(C)C1CC(NC2CN(C)C2)C1 |
| InChI | InChI=1S/C11H22N2/c1-8(2)9-4-10(5-9)12-11-6-13(3)7-11/h8-12H,4-7H2,1-3H3 |
| InChIKey | DJPOKNNNOGTOFV-UHFFFAOYSA-N |
| XLogP | 1.32 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 182.31 |
| LogP ≤ 5 | 1.32 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine?
The IUPAC name of 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine (CID 131107734) is 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine.
What is the SMILES notation for 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine?
The canonical SMILES for 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine is CC(C)C1CC(NC2CN(C)C2)C1.
What is the InChIKey of 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine?
The InChIKey is DJPOKNNNOGTOFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-8(2)9-4-10(5-9)12-11-6-13(3)7-11/h8-12H,4-7H2,1-3H3.
What are the key properties of 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine?
1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine has a molecular weight of 182.31 g/mol, XLogP of 1.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(3-propan-2-ylcyclobutyl)azetidin-3-amine is sourced from PubChem (CID 131107734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).