4-(2,6-difluorophenyl)morpholine;ethane

C14H23F2NO — CID 156637338

IUPAC4-(2,6-difluorophenyl)morpholine;ethane
SMILESCC.CC.Fc1cccc(F)c1N1CCOCC1
InChIInChI=1S/C10H11F2NO.2C2H6/c11-8-2-1-3-9(12)10(8)13-4-6-14-7-5-13;2*1-2/h1-3H,4-7H2;2*1-2H3
InChIKeyKKLDOBFNZLHTKT-UHFFFAOYSA-N
MW259.34 g/mol
LogP3.85
Rot. Bonds1

About 4-(2,6-difluorophenyl)morpholine;ethane

4-(2,6-difluorophenyl)morpholine;ethane (PubChem CID 156637338) has the molecular formula C14H23F2NO and a molecular weight of 259.34 g/mol. Its IUPAC name is 4-(2,6-difluorophenyl)morpholine;ethane.

Molecular Properties

Compound Name4-(2,6-difluorophenyl)morpholine;ethane
PubChem CID156637338
Molecular FormulaC14H23F2NO
Molecular Weight259.34 g/mol
Exact Mass259.17
IUPAC Name4-(2,6-difluorophenyl)morpholine;ethane
SMILESCC.CC.Fc1cccc(F)c1N1CCOCC1
InChIInChI=1S/C10H11F2NO.2C2H6/c11-8-2-1-3-9(12)10(8)13-4-6-14-7-5-13;2*1-2/h1-3H,4-7H2;2*1-2H3
InChIKeyKKLDOBFNZLHTKT-UHFFFAOYSA-N
XLogP3.85
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.34
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2,6-difluorophenyl)morpholine;ethane?
The IUPAC name of 4-(2,6-difluorophenyl)morpholine;ethane (CID 156637338) is 4-(2,6-difluorophenyl)morpholine;ethane.
What is the SMILES notation for 4-(2,6-difluorophenyl)morpholine;ethane?
The canonical SMILES for 4-(2,6-difluorophenyl)morpholine;ethane is CC.CC.Fc1cccc(F)c1N1CCOCC1.
What is the InChIKey of 4-(2,6-difluorophenyl)morpholine;ethane?
The InChIKey is KKLDOBFNZLHTKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO.2C2H6/c11-8-2-1-3-9(12)10(8)13-4-6-14-7-5-13;2*1-2/h1-3H,4-7H2;2*1-2H3.
What are the key properties of 4-(2,6-difluorophenyl)morpholine;ethane?
4-(2,6-difluorophenyl)morpholine;ethane has a molecular weight of 259.34 g/mol, XLogP of 3.85, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-difluorophenyl)morpholine;ethane is sourced from PubChem (CID 156637338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).