[3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone

C14H17FN2O3 — CID 125177233

IUPAC[3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone
SMILESO=C([C@H]1CNCCO1)N1CC(Oc2ccc(F)cc2)C1
InChIInChI=1S/C14H17FN2O3/c15-10-1-3-11(4-2-10)20-12-8-17(9-12)14(18)13-7-16-5-6-19-13/h1-4,12-13,16H,5-9H2/t13-/m1/s1
InChIKeyRUNSWPDZWVOMRI-CYBMUJFWSA-N
MW280.30 g/mol
LogP0.40
Rot. Bonds3

About [3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone

[3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone (PubChem CID 125177233) has the molecular formula C14H17FN2O3 and a molecular weight of 280.30 g/mol. Its IUPAC name is [3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone.

Molecular Properties

Compound Name[3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone
PubChem CID125177233
Molecular FormulaC14H17FN2O3
Molecular Weight280.30 g/mol
Exact Mass280.12
IUPAC Name[3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone
SMILESO=C([C@H]1CNCCO1)N1CC(Oc2ccc(F)cc2)C1
InChIInChI=1S/C14H17FN2O3/c15-10-1-3-11(4-2-10)20-12-8-17(9-12)14(18)13-7-16-5-6-19-13/h1-4,12-13,16H,5-9H2/t13-/m1/s1
InChIKeyRUNSWPDZWVOMRI-CYBMUJFWSA-N
XLogP0.40
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone?
The IUPAC name of [3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone (CID 125177233) is [3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone.
What is the SMILES notation for [3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone?
The canonical SMILES for [3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone is O=C([C@H]1CNCCO1)N1CC(Oc2ccc(F)cc2)C1.
What is the InChIKey of [3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone?
The InChIKey is RUNSWPDZWVOMRI-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H17FN2O3/c15-10-1-3-11(4-2-10)20-12-8-17(9-12)14(18)13-7-16-5-6-19-13/h1-4,12-13,16H,5-9H2/t13-/m1/s1.
What are the key properties of [3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone?
[3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone has a molecular weight of 280.30 g/mol, XLogP of 0.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-fluorophenoxy)azetidin-1-yl]-[(2R)-morpholin-2-yl]methanone is sourced from PubChem (CID 125177233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).