4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine

C14H29NO2 — CID 118890191

IUPAC4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine
SMILESCC[C@H](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/t14-/m1/s1
InChIKeyMXDUZCIWVGWQOL-CQSZACIVSA-N
MW243.39 g/mol
LogP2.55
Rot. Bonds9

About 4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine

4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine (PubChem CID 118890191) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine.

Molecular Properties

Compound Name4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine
PubChem CID118890191
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine
SMILESCC[C@H](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/t14-/m1/s1
InChIKeyMXDUZCIWVGWQOL-CQSZACIVSA-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-[(5R)-5-ethyl-7-methoxyheptyl]morpholine?
The IUPAC name of 4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine (CID 118890191) is 4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine.
What is the SMILES notation for 4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine?
The canonical SMILES for 4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine is CC[C@H](CCCCN1CCOCC1)CCOC.
What is the InChIKey of 4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine?
The InChIKey is MXDUZCIWVGWQOL-CQSZACIVSA-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/t14-/m1/s1.
What are the key properties of 4-[(5R)-5-ethyl-7-methoxyheptyl]morpholine?
4-[(5R)-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-[(5R)-5-ethyl-7-methoxyheptyl]morpholine is sourced from PubChem (CID 118890191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).