5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol

C12H25NO2 — CID 62229159

IUPAC5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol
SMILESCCC1COC(C)CN1CCCCCO
InChIInChI=1S/C12H25NO2/c1-3-12-10-15-11(2)9-13(12)7-5-4-6-8-14/h11-12,14H,3-10H2,1-2H3
InChIKeySOELFDOMPQMIPH-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.65
Rot. Bonds6

About 5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol

5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol (PubChem CID 62229159) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol.

Molecular Properties

Compound Name5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol
PubChem CID62229159
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol
SMILESCCC1COC(C)CN1CCCCCO
InChIInChI=1S/C12H25NO2/c1-3-12-10-15-11(2)9-13(12)7-5-4-6-8-14/h11-12,14H,3-10H2,1-2H3
InChIKeySOELFDOMPQMIPH-UHFFFAOYSA-N
XLogP1.65
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol?
The IUPAC name of 5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol (CID 62229159) is 5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol.
What is the SMILES notation for 5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol?
The canonical SMILES for 5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol is CCC1COC(C)CN1CCCCCO.
What is the InChIKey of 5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol?
The InChIKey is SOELFDOMPQMIPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-3-12-10-15-11(2)9-13(12)7-5-4-6-8-14/h11-12,14H,3-10H2,1-2H3.
What are the key properties of 5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol?
5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol has a molecular weight of 215.34 g/mol, XLogP of 1.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol is sourced from PubChem (CID 62229159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).