(1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol

C14H20FNO2 — CID 55184646

IUPAC(1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol
SMILESCC1CN(c2cccc(F)c2[C@@H](C)O)CC(C)O1
InChIInChI=1S/C14H20FNO2/c1-9-7-16(8-10(2)18-9)13-6-4-5-12(15)14(13)11(3)17/h4-6,9-11,17H,7-8H2,1-3H3/t9?,10?,11-/m1/s1
InChIKeyJNLVDHXJANHKDM-VQXHTEKXSA-N
MW253.32 g/mol
LogP2.49
Rot. Bonds2

About (1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol

(1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol (PubChem CID 55184646) has the molecular formula C14H20FNO2 and a molecular weight of 253.32 g/mol. Its IUPAC name is (1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol
PubChem CID55184646
Molecular FormulaC14H20FNO2
Molecular Weight253.32 g/mol
Exact Mass253.15
IUPAC Name(1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol
SMILESCC1CN(c2cccc(F)c2[C@@H](C)O)CC(C)O1
InChIInChI=1S/C14H20FNO2/c1-9-7-16(8-10(2)18-9)13-6-4-5-12(15)14(13)11(3)17/h4-6,9-11,17H,7-8H2,1-3H3/t9?,10?,11-/m1/s1
InChIKeyJNLVDHXJANHKDM-VQXHTEKXSA-N
XLogP2.49
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol
CID 43505903
1-[2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-6-fluorophenyl]ethanol
CID 81475031
(1S)-1-[2-(3,4-dimethylpiperidin-1-yl)-6-fluorophenyl]ethanol
CID 104874438
(1R)-1-(2-fluoro-6-pyrrolidin-1-ylphenyl)ethanol
CID 63371551
(1S)-1-[2-(3,4-dimethylpiperazin-1-yl)-6-fluorophenyl]ethanol
CID 78946556
1-[3-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-3-methylpiperidin-4-ol
CID 104940982
1-[3-fluoro-2-(1-hydroxyethyl)phenyl]pyrrolidin-3-ol
CID 62943959
(1S)-1-[2-(azocan-1-yl)-6-fluorophenyl]ethanol
CID 78939415
(1R)-1-[2-(azocan-1-yl)-6-fluorophenyl]ethanol
CID 55183727
(1R)-1-[2-(2,5-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol
CID 55185193
(1S)-1-[2-fluoro-6-(2,2,6,6-tetramethylmorpholin-4-yl)phenyl]ethanol
CID 102744613
1-[1-[3-fluoro-2-[(1S)-1-hydroxyethyl]phenyl]pyrrolidin-3-yl]ethanol
CID 113356001

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol?
The IUPAC name of (1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol (CID 55184646) is (1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol?
The canonical SMILES for (1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol is CC1CN(c2cccc(F)c2[C@@H](C)O)CC(C)O1.
What is the InChIKey of (1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol?
The InChIKey is JNLVDHXJANHKDM-VQXHTEKXSA-N. The full InChI is InChI=1S/C14H20FNO2/c1-9-7-16(8-10(2)18-9)13-6-4-5-12(15)14(13)11(3)17/h4-6,9-11,17H,7-8H2,1-3H3/t9?,10?,11-/m1/s1.
What are the key properties of (1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol?
(1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol has a molecular weight of 253.32 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-(2,6-dimethylmorpholin-4-yl)-6-fluorophenyl]ethanol is sourced from PubChem (CID 55184646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).