4-(5-ethyl-7-methoxyheptyl)morpholine

C14H29NO2 — CID 123827313

IUPAC4-(5-ethyl-7-methoxyheptyl)morpholine
SMILESCCC(CCCCN1CCOCC1)CCOC
InChIInChI=1S/C14H29NO2/c1-3-14(7-11-16-2)6-4-5-8-15-9-12-17-13-10-15/h14H,3-13H2,1-2H3
InChIKeyMXDUZCIWVGWQOL-UHFFFAOYSA-N
MW243.39 g/mol
LogP2.55
Rot. Bonds9

About 4-(5-ethyl-7-methoxyheptyl)morpholine

4-(5-ethyl-7-methoxyheptyl)morpholine (PubChem CID 123827313) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 4-(5-ethyl-7-methoxyheptyl)morpholine.

Molecular Properties

Compound Name4-(5-ethyl-7-methoxyheptyl)morpholine
PubChem CID123827313
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name4-(5-ethyl-7-methoxyheptyl)morpholine
SMILESCCC(CCCCN1CCOCC1)CCOC
InChIInChI=1S/C14H29NO2/c1-3-14(7-11-16-2)6-4-5-8-15-9-12-17-13-10-15/h14H,3-13H2,1-2H3
InChIKeyMXDUZCIWVGWQOL-UHFFFAOYSA-N
XLogP2.55
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 52.55
H-Bond Donors ≤ 50
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 4-(5-ethyl-7-methoxyheptyl)morpholine?
The IUPAC name of 4-(5-ethyl-7-methoxyheptyl)morpholine (CID 123827313) is 4-(5-ethyl-7-methoxyheptyl)morpholine.
What is the SMILES notation for 4-(5-ethyl-7-methoxyheptyl)morpholine?
The canonical SMILES for 4-(5-ethyl-7-methoxyheptyl)morpholine is CCC(CCCCN1CCOCC1)CCOC.
What is the InChIKey of 4-(5-ethyl-7-methoxyheptyl)morpholine?
The InChIKey is MXDUZCIWVGWQOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-3-14(7-11-16-2)6-4-5-8-15-9-12-17-13-10-15/h14H,3-13H2,1-2H3.
What are the key properties of 4-(5-ethyl-7-methoxyheptyl)morpholine?
4-(5-ethyl-7-methoxyheptyl)morpholine has a molecular weight of 243.39 g/mol, XLogP of 2.55, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-ethyl-7-methoxyheptyl)morpholine is sourced from PubChem (CID 123827313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).