(2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine

C14H20FNO2 — CID 888238

IUPAC(2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine
SMILESC[C@@H]1CN(CCOc2ccc(F)cc2)C[C@@H](C)O1
InChIInChI=1S/C14H20FNO2/c1-11-9-16(10-12(2)18-11)7-8-17-14-5-3-13(15)4-6-14/h3-6,11-12H,7-10H2,1-2H3/t11-,12-/m1/s1
InChIKeyBQHDAFJCLBCPRU-VXGBXAGGSA-N
MW253.32 g/mol
LogP2.31
Rot. Bonds4

About (2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine

(2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine (PubChem CID 888238) has the molecular formula C14H20FNO2 and a molecular weight of 253.32 g/mol. Its IUPAC name is (2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine.

Molecular Properties

Compound Name(2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine
PubChem CID888238
Molecular FormulaC14H20FNO2
Molecular Weight253.32 g/mol
Exact Mass253.15
IUPAC Name(2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine
SMILESC[C@@H]1CN(CCOc2ccc(F)cc2)C[C@@H](C)O1
InChIInChI=1S/C14H20FNO2/c1-11-9-16(10-12(2)18-11)7-8-17-14-5-3-13(15)4-6-14/h3-6,11-12H,7-10H2,1-2H3/t11-,12-/m1/s1
InChIKeyBQHDAFJCLBCPRU-VXGBXAGGSA-N
XLogP2.31
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]ethoxy]phenyl]acetic acid
CID 175940913
2-[4-[2-(2,6-dimethylmorpholin-4-yl)ethoxy]phenyl]ethanamine;dihydrochloride
CID 71941842
(2S,6S)-4-[4-(4-iodophenoxy)butyl]-2,6-dimethylmorpholine
CID 2182517
4-[2-(2,6-dimethylmorpholin-4-yl)ethoxy]benzenecarboximidamide
CID 61299819
(2R,6S)-2,6-dimethyl-4-[2-(3-propoxyphenoxy)ethyl]morpholine
CID 7394222
4-[3-[(2S,6R)-2,6-dimethylmorpholin-4-yl]propoxy]benzonitrile
CID 7380226
(2R,6S)-2,6-dimethyl-4-[2-(3-methylphenoxy)ethyl]morpholine
CID 51970005
(2R,6R)-2,6-dimethyl-4-[2-(2-propoxyphenoxy)ethyl]morpholine
CID 7394194
(2S,6S)-2,6-dimethyl-4-[2-(2-propoxyphenoxy)ethyl]morpholine
CID 7394196
(2S,6R)-2,6-dimethyl-4-[4-(4-propan-2-ylphenoxy)butyl]morpholine
CID 2182392
4-[2-[2-(2,6-dimethylmorpholin-4-yl)ethoxy]ethoxy]benzonitrile;hydrochloride
CID 2993844
[4-[2-(4-aminophenoxy)ethyl]-6-methylmorpholin-2-yl]methanol
CID 102932079

Frequently Asked Questions

What is the IUPAC name of (2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine?
The IUPAC name of (2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine (CID 888238) is (2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine.
What is the SMILES notation for (2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine?
The canonical SMILES for (2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine is C[C@@H]1CN(CCOc2ccc(F)cc2)C[C@@H](C)O1.
What is the InChIKey of (2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine?
The InChIKey is BQHDAFJCLBCPRU-VXGBXAGGSA-N. The full InChI is InChI=1S/C14H20FNO2/c1-11-9-16(10-12(2)18-11)7-8-17-14-5-3-13(15)4-6-14/h3-6,11-12H,7-10H2,1-2H3/t11-,12-/m1/s1.
What are the key properties of (2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine?
(2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine has a molecular weight of 253.32 g/mol, XLogP of 2.31, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-4-[2-(4-fluorophenoxy)ethyl]-2,6-dimethylmorpholine is sourced from PubChem (CID 888238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).