(2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine

C18H19F2NO2 — CID 22860724

IUPAC(2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine
SMILESFc1ccc(CCO[C@@H]2OCCN[C@H]2c2ccc(F)cc2)cc1
InChIInChI=1S/C18H19F2NO2/c19-15-5-1-13(2-6-15)9-11-22-18-17(21-10-12-23-18)14-3-7-16(20)8-4-14/h1-8,17-18,21H,9-12H2/t17-,18+/m0/s1
InChIKeyNLEQNGFDANHZFK-ZWKOTPCHSA-N
MW319.35 g/mol
LogP3.21
Rot. Bonds5

About (2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine

(2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine (PubChem CID 22860724) has the molecular formula C18H19F2NO2 and a molecular weight of 319.35 g/mol. Its IUPAC name is (2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine.

Molecular Properties

Compound Name(2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine
PubChem CID22860724
Molecular FormulaC18H19F2NO2
Molecular Weight319.35 g/mol
Exact Mass319.14
IUPAC Name(2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine
SMILESFc1ccc(CCO[C@@H]2OCCN[C@H]2c2ccc(F)cc2)cc1
InChIInChI=1S/C18H19F2NO2/c19-15-5-1-13(2-6-15)9-11-22-18-17(21-10-12-23-18)14-3-7-16(20)8-4-14/h1-8,17-18,21H,9-12H2/t17-,18+/m0/s1
InChIKeyNLEQNGFDANHZFK-ZWKOTPCHSA-N
XLogP3.21
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.35
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine?
The IUPAC name of (2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine (CID 22860724) is (2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine.
What is the SMILES notation for (2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine?
The canonical SMILES for (2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine is Fc1ccc(CCO[C@@H]2OCCN[C@H]2c2ccc(F)cc2)cc1.
What is the InChIKey of (2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine?
The InChIKey is NLEQNGFDANHZFK-ZWKOTPCHSA-N. The full InChI is InChI=1S/C18H19F2NO2/c19-15-5-1-13(2-6-15)9-11-22-18-17(21-10-12-23-18)14-3-7-16(20)8-4-14/h1-8,17-18,21H,9-12H2/t17-,18+/m0/s1.
What are the key properties of (2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine?
(2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine has a molecular weight of 319.35 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-3-(4-fluorophenyl)-2-[2-(4-fluorophenyl)ethoxy]morpholine is sourced from PubChem (CID 22860724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).