(2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine

C11H21FN2O — CID 177158766

IUPAC(2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine
SMILESCCN1CCO[C@@H]([C@@H](C)N2CC(F)C2)C1
InChIInChI=1S/C11H21FN2O/c1-3-13-4-5-15-11(8-13)9(2)14-6-10(12)7-14/h9-11H,3-8H2,1-2H3/t9-,11-/m1/s1
InChIKeyLCGGXQDZAVQJRM-MWLCHTKSSA-N
MW216.30 g/mol
LogP0.75
Rot. Bonds3

About (2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine

(2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine (PubChem CID 177158766) has the molecular formula C11H21FN2O and a molecular weight of 216.30 g/mol. Its IUPAC name is (2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine.

Molecular Properties

Compound Name(2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine
PubChem CID177158766
Molecular FormulaC11H21FN2O
Molecular Weight216.30 g/mol
Exact Mass216.16
IUPAC Name(2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine
SMILESCCN1CCO[C@@H]([C@@H](C)N2CC(F)C2)C1
InChIInChI=1S/C11H21FN2O/c1-3-13-4-5-15-11(8-13)9(2)14-6-10(12)7-14/h9-11H,3-8H2,1-2H3/t9-,11-/m1/s1
InChIKeyLCGGXQDZAVQJRM-MWLCHTKSSA-N
XLogP0.75
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.30
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(1-fluoroethyl)-4-propan-2-ylmorpholine
CID 117804156
2-(1,1-Difluoroethyl)-4-propan-2-ylmorpholine
CID 118390753
(2R,6S)-2-(1,1-difluoroethyl)-6-methyl-4-propan-2-ylmorpholine
CID 118390757
(2R,6R)-2-(1,1-difluoroethyl)-6-methyl-4-propan-2-ylmorpholine
CID 118390772
(3R,4S)-3-fluoro-1-(oxetan-3-yl)-4-propan-2-yloxypiperidine
CID 121261808
4-Propan-2-yl-2-(2,2,2-trifluoroethyl)morpholine
CID 146614610
(2R)-2-(fluoromethyl)-4-propan-2-ylmorpholine
CID 146880404
2-(2,2-Difluoroethyl)-4-propan-2-ylmorpholine
CID 153494051
(2R)-2-[(3-fluoroazetidin-1-yl)methyl]-4-propan-2-ylmorpholine
CID 156163856
2-[(3-Fluoroazetidin-1-yl)methyl]-4-propan-2-ylmorpholine
CID 156163857
(2R)-2-[(3-fluoroazetidin-1-yl)methyl]-4-methylmorpholine
CID 156166446
2-[(2S)-2-[(3-fluoroazetidin-1-yl)methyl]morpholin-4-yl]propane-1-thiol
CID 156172081

Frequently Asked Questions

What is the IUPAC name of (2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine?
The IUPAC name of (2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine (CID 177158766) is (2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine.
What is the SMILES notation for (2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine?
The canonical SMILES for (2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine is CCN1CCO[C@@H]([C@@H](C)N2CC(F)C2)C1.
What is the InChIKey of (2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine?
The InChIKey is LCGGXQDZAVQJRM-MWLCHTKSSA-N. The full InChI is InChI=1S/C11H21FN2O/c1-3-13-4-5-15-11(8-13)9(2)14-6-10(12)7-14/h9-11H,3-8H2,1-2H3/t9-,11-/m1/s1.
What are the key properties of (2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine?
(2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine has a molecular weight of 216.30 g/mol, XLogP of 0.75, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-ethyl-2-[(1R)-1-(3-fluoroazetidin-1-yl)ethyl]morpholine is sourced from PubChem (CID 177158766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).