About N-cyclohex-2-en-1-ylmorpholin-4-amine
N-cyclohex-2-en-1-ylmorpholin-4-amine (PubChem CID 107907734) has the molecular formula C10H18N2O
and a molecular weight of 182.27 g/mol. Its IUPAC name is N-cyclohex-2-en-1-ylmorpholin-4-amine.
Molecular Properties
| Compound Name | N-cyclohex-2-en-1-ylmorpholin-4-amine |
| PubChem CID | 107907734 |
| Molecular Formula | C10H18N2O |
| Molecular Weight | 182.27 g/mol |
| Exact Mass | 182.14 |
| IUPAC Name | N-cyclohex-2-en-1-ylmorpholin-4-amine |
| SMILES | C1=CC(NN2CCOCC2)CCC1 |
| InChI | InChI=1S/C10H18N2O/c1-2-4-10(5-3-1)11-12-6-8-13-9-7-12/h2,4,10-11H,1,3,5-9H2 |
| InChIKey | ITSAZIKCEKLFDJ-UHFFFAOYSA-N |
| XLogP | 0.93 |
| TPSA | 24.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 182.27 |
| LogP ≤ 5 | 0.93 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-cyclohex-2-en-1-ylmorpholin-4-amine?
The IUPAC name of N-cyclohex-2-en-1-ylmorpholin-4-amine (CID 107907734) is N-cyclohex-2-en-1-ylmorpholin-4-amine.
What is the SMILES notation for N-cyclohex-2-en-1-ylmorpholin-4-amine?
The canonical SMILES for N-cyclohex-2-en-1-ylmorpholin-4-amine is C1=CC(NN2CCOCC2)CCC1.
What is the InChIKey of N-cyclohex-2-en-1-ylmorpholin-4-amine?
The InChIKey is ITSAZIKCEKLFDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-2-4-10(5-3-1)11-12-6-8-13-9-7-12/h2,4,10-11H,1,3,5-9H2.
What are the key properties of N-cyclohex-2-en-1-ylmorpholin-4-amine?
N-cyclohex-2-en-1-ylmorpholin-4-amine has a molecular weight of 182.27 g/mol, XLogP of 0.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohex-2-en-1-ylmorpholin-4-amine is sourced from PubChem (CID 107907734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).