About 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine
3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine (PubChem CID 79083040) has the molecular formula C15H28N2O
and a molecular weight of 252.40 g/mol. Its IUPAC name is 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine.
Molecular Properties
| Compound Name | 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine |
| PubChem CID | 79083040 |
| Molecular Formula | C15H28N2O |
| Molecular Weight | 252.40 g/mol |
| Exact Mass | 252.22 |
| IUPAC Name | 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine |
| SMILES | CN1CCOC(CNC2CCCC(C3CC3)C2)C1 |
| InChI | InChI=1S/C15H28N2O/c1-17-7-8-18-15(11-17)10-16-14-4-2-3-13(9-14)12-5-6-12/h12-16H,2-11H2,1H3 |
| InChIKey | MBTKNJUHEZLXRB-UHFFFAOYSA-N |
| XLogP | 1.88 |
| TPSA | 24.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 252.40 |
| LogP ≤ 5 | 1.88 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine (CID 79083040) is 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine is CN1CCOC(CNC2CCCC(C3CC3)C2)C1.
What is the InChIKey of 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine?
The InChIKey is MBTKNJUHEZLXRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-17-7-8-18-15(11-17)10-16-14-4-2-3-13(9-14)12-5-6-12/h12-16H,2-11H2,1H3.
What are the key properties of 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine?
3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine has a molecular weight of 252.40 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 79083040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).