2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol

C15H22FNO2 — CID 111565155

IUPAC2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol
SMILESCCC1COCCN1CC(O)c1ccc(F)cc1C
InChIInChI=1S/C15H22FNO2/c1-3-13-10-19-7-6-17(13)9-15(18)14-5-4-12(16)8-11(14)2/h4-5,8,13,15,18H,3,6-7,9-10H2,1-2H3
InChIKeyMKGRKEFSEUQUOK-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.28
Rot. Bonds4

About 2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol

2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol (PubChem CID 111565155) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is 2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol
PubChem CID111565155
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol
SMILESCCC1COCCN1CC(O)c1ccc(F)cc1C
InChIInChI=1S/C15H22FNO2/c1-3-13-10-19-7-6-17(13)9-15(18)14-5-4-12(16)8-11(14)2/h4-5,8,13,15,18H,3,6-7,9-10H2,1-2H3
InChIKeyMKGRKEFSEUQUOK-UHFFFAOYSA-N
XLogP2.28
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,4-difluorophenyl)-2-(3-ethylmorpholin-4-yl)ethanol
CID 111382198
1-(4-fluoro-2-methylphenyl)-2-[3-(2-methyl-1,2,4-triazol-3-yl)morpholin-4-yl]ethanol
CID 154756495
2-[(3-ethylmorpholin-4-yl)methyl]-4-fluorobenzoic acid
CID 114014611
(1S)-1-(4-fluoro-2-methylphenyl)propan-1-ol
CID 79002158
1-[2-(4-fluoro-2-methylphenyl)-2-hydroxyethyl]-N-methylpyrrolidine-2-carboxamide
CID 111564989
4-[2-(4-fluoro-2-methylphenyl)-2-hydroxyethyl]-3-propan-2-ylpiperazin-2-one
CID 111565059
2-(3,3-dimethylpyrrolidin-1-yl)-1-(4-fluoro-2-methylphenyl)ethanol
CID 111565203
1-(4-fluoro-2-methylphenyl)-2-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-1-yl]ethanol
CID 111564899
N-(2-amino-5-fluorophenyl)-2-(3-ethylmorpholin-4-yl)acetamide
CID 43612167
1-(4-fluoro-2-methylphenyl)-2-[4-(4-methylcyclohexyl)piperazin-1-yl]ethanol
CID 111565154
2-(3-ethylmorpholin-4-yl)-1-phenylethanamine
CID 43613110
(3S)-4-benzyl-3-ethylmorpholine
CID 54501252

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol?
The IUPAC name of 2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol (CID 111565155) is 2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol.
What is the SMILES notation for 2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol?
The canonical SMILES for 2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol is CCC1COCCN1CC(O)c1ccc(F)cc1C.
What is the InChIKey of 2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol?
The InChIKey is MKGRKEFSEUQUOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c1-3-13-10-19-7-6-17(13)9-15(18)14-5-4-12(16)8-11(14)2/h4-5,8,13,15,18H,3,6-7,9-10H2,1-2H3.
What are the key properties of 2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol?
2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol has a molecular weight of 267.34 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylmorpholin-4-yl)-1-(4-fluoro-2-methylphenyl)ethanol is sourced from PubChem (CID 111565155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).