1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol

C18H18F3NO2 — CID 110928528

IUPAC1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol
SMILESOC(CN1CCOC(c2ccccc2F)C1)c1c(F)cccc1F
InChIInChI=1S/C18H18F3NO2/c19-13-5-2-1-4-12(13)17-11-22(8-9-24-17)10-16(23)18-14(20)6-3-7-15(18)21/h1-7,16-17,23H,8-11H2
InChIKeyGNORRWRJZVXKBM-UHFFFAOYSA-N
MW337.34 g/mol
LogP3.21
Rot. Bonds4

About 1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol

1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol (PubChem CID 110928528) has the molecular formula C18H18F3NO2 and a molecular weight of 337.34 g/mol. Its IUPAC name is 1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol.

Molecular Properties

Compound Name1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol
PubChem CID110928528
Molecular FormulaC18H18F3NO2
Molecular Weight337.34 g/mol
Exact Mass337.13
IUPAC Name1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol
SMILESOC(CN1CCOC(c2ccccc2F)C1)c1c(F)cccc1F
InChIInChI=1S/C18H18F3NO2/c19-13-5-2-1-4-12(13)17-11-22(8-9-24-17)10-16(23)18-14(20)6-3-7-15(18)21/h1-7,16-17,23H,8-11H2
InChIKeyGNORRWRJZVXKBM-UHFFFAOYSA-N
XLogP3.21
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2-fluorophenyl)morpholin-4-yl]-3-phenylmethoxypropan-2-ol
CID 110929071
2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine
CID 82024344
1-(4-fluorophenyl)-2-[2-(3-fluorophenyl)morpholin-4-yl]ethanol
CID 110928538
1-(2,6-difluorophenyl)-2-(4-methylpiperidin-1-yl)ethanol
CID 110897208
(1S)-2-[(2S)-2-(4-ethyl-1,2,4-triazol-3-yl)morpholin-4-yl]-1-(2-fluorophenyl)ethanol
CID 129331030
cyclopentyl-[2-(2-fluorophenyl)morpholin-4-yl]methanone
CID 71684127
2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone
CID 110663780
(2S)-2-amino-1-[2-(2-fluorophenyl)morpholin-4-yl]-4-methylsulfanylbutan-1-one
CID 154750663
2-cyclopentyl-1-[2-(2-fluorophenyl)morpholin-4-yl]propan-1-one
CID 110416436
[4-(aminomethyl)phenyl]-[2-(2-fluorophenyl)morpholin-4-yl]methanone
CID 119315888
1-[2-(2,4-dichloro-5-fluorophenyl)morpholin-4-yl]-3-(2-methylphenoxy)propan-2-ol;hydrochloride
CID 138959744
3-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]-2-methylpropan-1-one
CID 110414688

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol?
The IUPAC name of 1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol (CID 110928528) is 1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol.
What is the SMILES notation for 1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol?
The canonical SMILES for 1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol is OC(CN1CCOC(c2ccccc2F)C1)c1c(F)cccc1F.
What is the InChIKey of 1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol?
The InChIKey is GNORRWRJZVXKBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F3NO2/c19-13-5-2-1-4-12(13)17-11-22(8-9-24-17)10-16(23)18-14(20)6-3-7-15(18)21/h1-7,16-17,23H,8-11H2.
What are the key properties of 1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol?
1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol has a molecular weight of 337.34 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluorophenyl)-2-[2-(2-fluorophenyl)morpholin-4-yl]ethanol is sourced from PubChem (CID 110928528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).