2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine

C24H25NO3 — CID 68545339

IUPAC2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine
SMILESc1ccc(COc2ccccc2O[C@@H](c2ccccc2)C2CNCCO2)cc1
InChIInChI=1S/C24H25NO3/c1-3-9-19(10-4-1)18-27-21-13-7-8-14-22(21)28-24(20-11-5-2-6-12-20)23-17-25-15-16-26-23/h1-14,23-25H,15-18H2/t23?,24-/m0/s1
InChIKeyUURHVASWZNNURQ-CGAIIQECSA-N
MW375.47 g/mol
LogP4.37
Rot. Bonds7

About 2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine

2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine (PubChem CID 68545339) has the molecular formula C24H25NO3 and a molecular weight of 375.47 g/mol. Its IUPAC name is 2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine.

Molecular Properties

Compound Name2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine
PubChem CID68545339
Molecular FormulaC24H25NO3
Molecular Weight375.47 g/mol
Exact Mass375.18
IUPAC Name2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine
SMILESc1ccc(COc2ccccc2O[C@@H](c2ccccc2)C2CNCCO2)cc1
InChIInChI=1S/C24H25NO3/c1-3-9-19(10-4-1)18-27-21-13-7-8-14-22(21)28-24(20-11-5-2-6-12-20)23-17-25-15-16-26-23/h1-14,23-25H,15-18H2/t23?,24-/m0/s1
InChIKeyUURHVASWZNNURQ-CGAIIQECSA-N
XLogP4.37
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-[(S)-(2-phenylmethoxyphenoxy)-pyridin-2-ylmethyl]morpholine
CID 59166872
(2R)-2-[(R)-(2-ethoxyphenoxy)-phenylmethyl]morpholine;hydrochloride
CID 46178247
2-[[2-(methoxymethyl)phenoxy]-phenylmethyl]morpholine
CID 11709415
2-[(2-ethoxyphenoxy)methyl]morpholine;(2S)-2-[(S)-(2-ethoxyphenoxy)-phenylmethyl]morpholine
CID 174902132
(2R)-2-[(S)-(2-methylphenoxy)-phenylmethyl]morpholine
CID 45101528
2-[(S)-phenyl-[2-(trifluoromethoxy)phenoxy]methyl]morpholine
CID 68542186
(2S)-2-[(S)-(2-ethoxyphenoxy)-phenylmethyl]morpholine;methanesulfonic acid;hydrate
CID 88922222
2-[(2-ethoxyphenoxy)-(4-methylphenyl)methyl]morpholine
CID 74337094
(2S)-2-[phenoxy(phenyl)methyl]morpholine
CID 68539153
(2S)-2-[(2-ethoxy-5-fluorophenoxy)-phenylmethyl]morpholine
CID 59166814
(2S)-2-[[2-(2-methylpropyl)phenoxy]-phenylmethyl]morpholine
CID 68538263
2-[(2-ethoxyphenoxy)-(4-methoxyphenyl)methyl]morpholine
CID 10066040

Frequently Asked Questions

What is the IUPAC name of 2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine?
The IUPAC name of 2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine (CID 68545339) is 2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine.
What is the SMILES notation for 2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine?
The canonical SMILES for 2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine is c1ccc(COc2ccccc2O[C@@H](c2ccccc2)C2CNCCO2)cc1.
What is the InChIKey of 2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine?
The InChIKey is UURHVASWZNNURQ-CGAIIQECSA-N. The full InChI is InChI=1S/C24H25NO3/c1-3-9-19(10-4-1)18-27-21-13-7-8-14-22(21)28-24(20-11-5-2-6-12-20)23-17-25-15-16-26-23/h1-14,23-25H,15-18H2/t23?,24-/m0/s1.
What are the key properties of 2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine?
2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine has a molecular weight of 375.47 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(S)-phenyl-(2-phenylmethoxyphenoxy)methyl]morpholine is sourced from PubChem (CID 68545339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).