About N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine
N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine (PubChem CID 130921273) has the molecular formula C10H20N2
and a molecular weight of 168.28 g/mol. Its IUPAC name is N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine.
Molecular Properties
| Compound Name | N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine |
| PubChem CID | 130921273 |
| Molecular Formula | C10H20N2 |
| Molecular Weight | 168.28 g/mol |
| Exact Mass | 168.16 |
| IUPAC Name | N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine |
| SMILES | CC1CCC(NCC2CCN2)C1 |
| InChI | InChI=1S/C10H20N2/c1-8-2-3-9(6-8)12-7-10-4-5-11-10/h8-12H,2-7H2,1H3 |
| InChIKey | NWYVKZSTBZWGLS-UHFFFAOYSA-N |
| XLogP | 1.13 |
| TPSA | 24.06 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 168.28 |
| LogP ≤ 5 | 1.13 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine?
The IUPAC name of N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine (CID 130921273) is N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine.
What is the SMILES notation for N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine?
The canonical SMILES for N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine is CC1CCC(NCC2CCN2)C1.
What is the InChIKey of N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine?
The InChIKey is NWYVKZSTBZWGLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-8-2-3-9(6-8)12-7-10-4-5-11-10/h8-12H,2-7H2,1H3.
What are the key properties of N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine?
N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine has a molecular weight of 168.28 g/mol, XLogP of 1.13, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine is sourced from PubChem (CID 130921273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).