(3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride

C11H15ClFNO2 — CID 171192539

IUPAC(3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride
SMILESCOc1ccc([C@@H]2COCCN2)cc1F.Cl
InChIInChI=1S/C11H14FNO2.ClH/c1-14-11-3-2-8(6-9(11)12)10-7-15-5-4-13-10;/h2-3,6,10,13H,4-5,7H2,1H3;1H/t10-;/m0./s1
InChIKeyVNIVBDCGGVDJFV-PPHPATTJSA-N
MW247.70 g/mol
LogP1.92
Rot. Bonds2

About (3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride

(3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride (PubChem CID 171192539) has the molecular formula C11H15ClFNO2 and a molecular weight of 247.70 g/mol. Its IUPAC name is (3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride.

Molecular Properties

Compound Name(3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride
PubChem CID171192539
Molecular FormulaC11H15ClFNO2
Molecular Weight247.70 g/mol
Exact Mass247.08
IUPAC Name(3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride
SMILESCOc1ccc([C@@H]2COCCN2)cc1F.Cl
InChIInChI=1S/C11H14FNO2.ClH/c1-14-11-3-2-8(6-9(11)12)10-7-15-5-4-13-10;/h2-3,6,10,13H,4-5,7H2,1H3;1H/t10-;/m0./s1
InChIKeyVNIVBDCGGVDJFV-PPHPATTJSA-N
XLogP1.92
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.70
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride
CID 171193072
(3R)-3-(3,4-dimethoxyphenyl)morpholine
CID 42183336
3-(4-ethoxy-3-fluorophenyl)morpholine
CID 82287553
3-(3,4-difluoro-5-methoxyphenyl)morpholine
CID 84792610
3-(3-ethyl-4-methoxyphenyl)morpholine
CID 82286598
3-(4-methoxy-3-propan-2-ylphenyl)morpholine
CID 82083415
2-fluoro-4-[(3R)-morpholin-3-yl]phenol
CID 96758561
(3S)-3-(3,4-dimethylphenyl)morpholine;hydrochloride
CID 171193047
(3R)-3-(3,4,5-trifluorophenyl)morpholine;hydrochloride
CID 171192647
(3S)-3-(3,4,5-trifluorophenyl)morpholine;hydrochloride
CID 171193179
(3S)-3-(4-methoxy-3-phenylmethoxyphenyl)morpholine;hydrochloride
CID 171193382
(3S)-3-(3,4,5-trifluorophenyl)morpholine
CID 131573948

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride?
The IUPAC name of (3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride (CID 171192539) is (3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride.
What is the SMILES notation for (3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride?
The canonical SMILES for (3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride is COc1ccc([C@@H]2COCCN2)cc1F.Cl.
What is the InChIKey of (3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride?
The InChIKey is VNIVBDCGGVDJFV-PPHPATTJSA-N. The full InChI is InChI=1S/C11H14FNO2.ClH/c1-14-11-3-2-8(6-9(11)12)10-7-15-5-4-13-10;/h2-3,6,10,13H,4-5,7H2,1H3;1H/t10-;/m0./s1.
What are the key properties of (3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride?
(3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride has a molecular weight of 247.70 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(3-fluoro-4-methoxyphenyl)morpholine;hydrochloride is sourced from PubChem (CID 171192539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).