About 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride
1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride (PubChem CID 134690905) has the molecular formula C10H20ClN
and a molecular weight of 189.73 g/mol. Its IUPAC name is 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride.
Molecular Properties
| Compound Name | 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride |
| PubChem CID | 134690905 |
| Molecular Formula | C10H20ClN |
| Molecular Weight | 189.73 g/mol |
| Exact Mass | 189.13 |
| IUPAC Name | 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride |
| SMILES | C1CC(CNCC2CCC2)C1.Cl |
| InChI | InChI=1S/C10H19N.ClH/c1-3-9(4-1)7-11-8-10-5-2-6-10;/h9-11H,1-8H2;1H |
| InChIKey | WQLMONWIIOCTQX-UHFFFAOYSA-N |
| XLogP | 2.60 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 189.73 |
| LogP ≤ 5 | 2.60 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride?
The IUPAC name of 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride (CID 134690905) is 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride.
What is the SMILES notation for 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride?
The canonical SMILES for 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride is C1CC(CNCC2CCC2)C1.Cl.
What is the InChIKey of 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride?
The InChIKey is WQLMONWIIOCTQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N.ClH/c1-3-9(4-1)7-11-8-10-5-2-6-10;/h9-11H,1-8H2;1H.
What are the key properties of 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride?
1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride has a molecular weight of 189.73 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-(cyclobutylmethyl)methanamine;hydrochloride is sourced from PubChem (CID 134690905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).