4-[6-(2,2-difluoropropoxy)hexyl]morpholine

C13H25F2NO2 — CID 58341567

IUPAC4-[6-(2,2-difluoropropoxy)hexyl]morpholine
SMILESCC(F)(F)COCCCCCCN1CCOCC1
InChIInChI=1S/C13H25F2NO2/c1-13(14,15)12-18-9-5-3-2-4-6-16-7-10-17-11-8-16/h2-12H2,1H3
InChIKeyWXEAZHHYQUXEPN-UHFFFAOYSA-N
MW265.34 g/mol
LogP2.55
Rot. Bonds9

About 4-[6-(2,2-difluoropropoxy)hexyl]morpholine

4-[6-(2,2-difluoropropoxy)hexyl]morpholine (PubChem CID 58341567) has the molecular formula C13H25F2NO2 and a molecular weight of 265.34 g/mol. Its IUPAC name is 4-[6-(2,2-difluoropropoxy)hexyl]morpholine.

Molecular Properties

Compound Name4-[6-(2,2-difluoropropoxy)hexyl]morpholine
PubChem CID58341567
Molecular FormulaC13H25F2NO2
Molecular Weight265.34 g/mol
Exact Mass265.19
IUPAC Name4-[6-(2,2-difluoropropoxy)hexyl]morpholine
SMILESCC(F)(F)COCCCCCCN1CCOCC1
InChIInChI=1S/C13H25F2NO2/c1-13(14,15)12-18-9-5-3-2-4-6-16-7-10-17-11-8-16/h2-12H2,1H3
InChIKeyWXEAZHHYQUXEPN-UHFFFAOYSA-N
XLogP2.55
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.34
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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Related Compounds

4-Methyl-4-[2-(2,2,3,3,4,4,5,5-octafluoropentoxy)ethyl]morpholin-4-ium
CID 101731129
4-(1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluorohexyl)morpholine
CID 21692130
4-[2-(2,2-Difluoropropoxy)cyclohexyl]morpholine
CID 58341559
4-[12-(2,2-Difluoropropoxy)dodecyl]morpholine
CID 58341574
4-[8-(2,2-Difluoropropoxy)octyl]morpholine
CID 58341579
6-Morpholin-4-ylhexyl 2,2-difluoropropanoate
CID 58341585
4-[4-(2,2-Difluoropropoxy)butyl]morpholine
CID 58341589
1-[2-(2,2,3,3,4,4,4-Heptafluorobutoxy)ethyl]piperidine
CID 59203986
1-[2-(2,2,3,3,4,4,5,5-Octafluoropentoxy)ethyl]piperidine
CID 59204081
1-[2-(2,2,2-Trifluoroethoxy)ethyl]piperidine
CID 59204082
1-[2-(1,1,1-Trifluoropropan-2-yloxy)ethyl]piperidine
CID 59204085
1-[2-(2,2,3,3,3-Pentafluoropropoxy)ethyl]piperidine
CID 59204094

Frequently Asked Questions

What is the IUPAC name of 4-[6-(2,2-difluoropropoxy)hexyl]morpholine?
The IUPAC name of 4-[6-(2,2-difluoropropoxy)hexyl]morpholine (CID 58341567) is 4-[6-(2,2-difluoropropoxy)hexyl]morpholine.
What is the SMILES notation for 4-[6-(2,2-difluoropropoxy)hexyl]morpholine?
The canonical SMILES for 4-[6-(2,2-difluoropropoxy)hexyl]morpholine is CC(F)(F)COCCCCCCN1CCOCC1.
What is the InChIKey of 4-[6-(2,2-difluoropropoxy)hexyl]morpholine?
The InChIKey is WXEAZHHYQUXEPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25F2NO2/c1-13(14,15)12-18-9-5-3-2-4-6-16-7-10-17-11-8-16/h2-12H2,1H3.
What are the key properties of 4-[6-(2,2-difluoropropoxy)hexyl]morpholine?
4-[6-(2,2-difluoropropoxy)hexyl]morpholine has a molecular weight of 265.34 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-[6-(2,2-difluoropropoxy)hexyl]morpholine is sourced from PubChem (CID 58341567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).