1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol

C15H22FNO3 — CID 59563430

IUPAC1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol
SMILESCC1CN(CC(O)COc2cccc(F)c2)CC(C)O1
InChIInChI=1S/C15H22FNO3/c1-11-7-17(8-12(2)20-11)9-14(18)10-19-15-5-3-4-13(16)6-15/h3-6,11-12,14,18H,7-10H2,1-2H3
InChIKeySOYFLFKBUQZXHT-UHFFFAOYSA-N
MW283.34 g/mol
LogP1.67
Rot. Bonds5

About 1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol

1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol (PubChem CID 59563430) has the molecular formula C15H22FNO3 and a molecular weight of 283.34 g/mol. Its IUPAC name is 1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol.

Molecular Properties

Compound Name1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol
PubChem CID59563430
Molecular FormulaC15H22FNO3
Molecular Weight283.34 g/mol
Exact Mass283.16
IUPAC Name1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol
SMILESCC1CN(CC(O)COc2cccc(F)c2)CC(C)O1
InChIInChI=1S/C15H22FNO3/c1-11-7-17(8-12(2)20-11)9-14(18)10-19-15-5-3-4-13(16)6-15/h3-6,11-12,14,18H,7-10H2,1-2H3
InChIKeySOYFLFKBUQZXHT-UHFFFAOYSA-N
XLogP1.67
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,6-dimethylmorpholin-4-yl)-3-[3-(trifluoromethyl)phenoxy]propan-2-ol
CID 59563443
1-(4-bromo-3-fluorophenoxy)-3-(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 59563422
1-(2,5-difluorophenoxy)-3-(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 109415726
1-(2-chloro-4-fluorophenoxy)-3-(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 110884437
1-(2,6-dimethylmorpholin-4-yl)-3-(4-ethylphenoxy)propan-2-ol chloride
CID 21237651
(2R)-1-(1,3-benzodioxol-5-yloxy)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propan-2-ol
CID 878803
1-(2,6-dimethylmorpholin-4-yl)-3-(3,5-dimethylphenoxy)propan-2-ol chloride
CID 21237837
(2S)-1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-(2,6-dimethylphenoxy)propan-2-ol
CID 7428342
1-(2-ethyl-6-methylmorpholin-4-yl)-3-(4-fluorophenoxy)propan-2-ol
CID 111113659
(2S)-1-dibenzofuran-2-yloxy-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propan-2-ol
CID 7745763
1-(2,6-dimethylmorpholin-4-yl)-3-(4-propan-2-ylphenoxy)propan-2-ol chloride
CID 21237688
1-(2,6-dimethoxyphenoxy)-3-(2,6-dimethylmorpholin-4-yl)propan-2-ol
CID 3530693

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol?
The IUPAC name of 1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol (CID 59563430) is 1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol.
What is the SMILES notation for 1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol?
The canonical SMILES for 1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol is CC1CN(CC(O)COc2cccc(F)c2)CC(C)O1.
What is the InChIKey of 1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol?
The InChIKey is SOYFLFKBUQZXHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO3/c1-11-7-17(8-12(2)20-11)9-14(18)10-19-15-5-3-4-13(16)6-15/h3-6,11-12,14,18H,7-10H2,1-2H3.
What are the key properties of 1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol?
1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol has a molecular weight of 283.34 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylmorpholin-4-yl)-3-(3-fluorophenoxy)propan-2-ol is sourced from PubChem (CID 59563430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).