(3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride

C11H14ClF2NO2 — CID 171192805

IUPAC(3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride
SMILESCl.FC(F)Oc1ccccc1[C@@H]1COCCN1
InChIInChI=1S/C11H13F2NO2.ClH/c12-11(13)16-10-4-2-1-3-8(10)9-7-15-6-5-14-9;/h1-4,9,11,14H,5-7H2;1H/t9-;/m0./s1
InChIKeyXLLJMFYGVAJALW-FVGYRXGTSA-N
MW265.69 g/mol
LogP2.37
Rot. Bonds3

About (3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride

(3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride (PubChem CID 171192805) has the molecular formula C11H14ClF2NO2 and a molecular weight of 265.69 g/mol. Its IUPAC name is (3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride.

Molecular Properties

Compound Name(3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride
PubChem CID171192805
Molecular FormulaC11H14ClF2NO2
Molecular Weight265.69 g/mol
Exact Mass265.07
IUPAC Name(3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride
SMILESCl.FC(F)Oc1ccccc1[C@@H]1COCCN1
InChIInChI=1S/C11H13F2NO2.ClH/c12-11(13)16-10-4-2-1-3-8(10)9-7-15-6-5-14-9;/h1-4,9,11,14H,5-7H2;1H/t9-;/m0./s1
InChIKeyXLLJMFYGVAJALW-FVGYRXGTSA-N
XLogP2.37
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.69
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-[2-(1,1,2,2-tetrafluoroethoxy)phenyl]morpholine
CID 171192719
(3S)-3-[2-(trifluoromethoxy)phenyl]morpholine
CID 171193298
(3R)-3-(2-ethoxyphenyl)morpholine
CID 42183310
3-(2-bromophenyl)morpholine;hydrochloride
CID 155487565
2-morpholin-3-ylphenol
CID 55294349
(3R)-3-(2,3-difluorophenyl)morpholine;hydrochloride
CID 171192608
(3R)-3-naphthalen-1-ylmorpholine;hydrochloride
CID 171192824
2-[(3S)-morpholin-3-yl]benzonitrile;hydrochloride
CID 171193088
3-(4-fluoro-2-methoxyphenyl)morpholine
CID 82612677
3-[2-(difluoromethoxy)phenyl]-1,4-thiazepane 1-oxide
CID 66217780
(3S)-3-(2-bromo-3-fluorophenyl)morpholine;hydrochloride
CID 171193150
(3R)-3-(2-tert-butylsulfanylphenyl)morpholine
CID 171192913

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride?
The IUPAC name of (3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride (CID 171192805) is (3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride.
What is the SMILES notation for (3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride?
The canonical SMILES for (3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride is Cl.FC(F)Oc1ccccc1[C@@H]1COCCN1.
What is the InChIKey of (3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride?
The InChIKey is XLLJMFYGVAJALW-FVGYRXGTSA-N. The full InChI is InChI=1S/C11H13F2NO2.ClH/c12-11(13)16-10-4-2-1-3-8(10)9-7-15-6-5-14-9;/h1-4,9,11,14H,5-7H2;1H/t9-;/m0./s1.
What are the key properties of (3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride?
(3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride has a molecular weight of 265.69 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[2-(difluoromethoxy)phenyl]morpholine;hydrochloride is sourced from PubChem (CID 171192805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).