Morpholine; N-Me
AlkaPlorer ID: AK000869
Synonym: N-Methylmorpholine
IUPAC Name: 4-methylmorpholine
Structure
SMILES: CN1CCOCC1
InChI: InChI=1S/C5H11NO/c1-6-2-4-7-5-3-6/h2-5H2,1H3
InChIKey: SJRJJKPEHAURKC-UHFFFAOYSA-N
Reference
Isolation of N-methylmorpholine from the seeds of Cassia occidentalis (coffee senna)
PubChem CID: 7972
CAS: 109-02-4
LOTUS: LTS0010503
SuperNatural Ⅲ: SN0347341
COCONUT: CNP0225764
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Cassia | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| None | Cassia | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 101.149
TPSA？: 12.47
MolLogP？: -0.0516
Number of H-Donors: 0
Number of H-Acceptors: 2
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| None | No relevant target | pKa | 7.4 | None | 10.1007/s11095-013-1232-z |
| None | No relevant target | pKa | 7.4 | None | 10.1021/jm00195a026 |