2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine

C20H24FNO3 — CID 11348526

IUPAC2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine
SMILESCCOc1ccccc1OCC1CN(Cc2ccc(F)cc2)CCO1
InChIInChI=1S/C20H24FNO3/c1-2-23-19-5-3-4-6-20(19)25-15-18-14-22(11-12-24-18)13-16-7-9-17(21)10-8-16/h3-10,18H,2,11-15H2,1H3
InChIKeySWIAKCKADZHKFN-UHFFFAOYSA-N
MW345.41 g/mol
LogP3.50
Rot. Bonds7

About 2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine

2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine (PubChem CID 11348526) has the molecular formula C20H24FNO3 and a molecular weight of 345.41 g/mol. Its IUPAC name is 2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine.

Molecular Properties

Compound Name2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine
PubChem CID11348526
Molecular FormulaC20H24FNO3
Molecular Weight345.41 g/mol
Exact Mass345.17
IUPAC Name2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine
SMILESCCOc1ccccc1OCC1CN(Cc2ccc(F)cc2)CCO1
InChIInChI=1S/C20H24FNO3/c1-2-23-19-5-3-4-6-20(19)25-15-18-14-22(11-12-24-18)13-16-7-9-17(21)10-8-16/h3-10,18H,2,11-15H2,1H3
InChIKeySWIAKCKADZHKFN-UHFFFAOYSA-N
XLogP3.50
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine?
The IUPAC name of 2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine (CID 11348526) is 2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine.
What is the SMILES notation for 2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine?
The canonical SMILES for 2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine is CCOc1ccccc1OCC1CN(Cc2ccc(F)cc2)CCO1.
What is the InChIKey of 2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine?
The InChIKey is SWIAKCKADZHKFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FNO3/c1-2-23-19-5-3-4-6-20(19)25-15-18-14-22(11-12-24-18)13-16-7-9-17(21)10-8-16/h3-10,18H,2,11-15H2,1H3.
What are the key properties of 2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine?
2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine has a molecular weight of 345.41 g/mol, XLogP of 3.50, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethoxyphenoxy)methyl]-4-[(4-fluorophenyl)methyl]morpholine is sourced from PubChem (CID 11348526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).