4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol

C15H22FNO2 — CID 107720941

IUPAC4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol
SMILESCCC1COC(C)CN1C(C)c1ccc(O)cc1F
InChIInChI=1S/C15H22FNO2/c1-4-12-9-19-10(2)8-17(12)11(3)14-6-5-13(18)7-15(14)16/h5-7,10-12,18H,4,8-9H2,1-3H3
InChIKeyJRRDHLDYISPZHP-UHFFFAOYSA-N
MW267.34 g/mol
LogP3.09
Rot. Bonds3

About 4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol

4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol (PubChem CID 107720941) has the molecular formula C15H22FNO2 and a molecular weight of 267.34 g/mol. Its IUPAC name is 4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol.

Molecular Properties

Compound Name4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol
PubChem CID107720941
Molecular FormulaC15H22FNO2
Molecular Weight267.34 g/mol
Exact Mass267.16
IUPAC Name4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol
SMILESCCC1COC(C)CN1C(C)c1ccc(O)cc1F
InChIInChI=1S/C15H22FNO2/c1-4-12-9-19-10(2)8-17(12)11(3)14-6-5-13(18)7-15(14)16/h5-7,10-12,18H,4,8-9H2,1-3H3
InChIKeyJRRDHLDYISPZHP-UHFFFAOYSA-N
XLogP3.09
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-5-fluorophenol
CID 82975113
1-(3,4-difluorophenyl)-2-(5-ethyl-2-methylmorpholin-4-yl)propan-1-one
CID 60680522
2-[4-[1-(2-fluoro-4-hydroxyphenyl)ethyl]morpholin-3-yl]acetic acid
CID 107720928
2-(5-ethyl-2-methylmorpholin-4-yl)-1-(4-methylphenyl)propan-1-one
CID 60680544
4-[1-[2-(aminomethyl)-6-methylpiperidin-1-yl]ethyl]-3-fluorophenol
CID 107720769
4-[1-(2,5-diethylpiperazin-1-yl)ethyl]benzene-1,3-diol
CID 64977805
(2-chloro-5-hydroxyphenyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone
CID 106501494
3-amino-2-(5-ethyl-2-methylmorpholin-4-yl)propan-1-ol
CID 104710882
2-(3,5-dichlorophenyl)-2-(5-ethyl-2-methylmorpholin-4-yl)ethanamine
CID 61424175
2-(4-chlorophenyl)-2-(5-ethyl-2-methylmorpholin-4-yl)ethanamine
CID 61424086
3-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-amine
CID 43575822
2-[(5-ethyl-2-methylmorpholin-4-yl)methyl]-6-fluorophenol
CID 112616028

Frequently Asked Questions

What is the IUPAC name of 4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol?
The IUPAC name of 4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol (CID 107720941) is 4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol.
What is the SMILES notation for 4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol?
The canonical SMILES for 4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol is CCC1COC(C)CN1C(C)c1ccc(O)cc1F.
What is the InChIKey of 4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol?
The InChIKey is JRRDHLDYISPZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO2/c1-4-12-9-19-10(2)8-17(12)11(3)14-6-5-13(18)7-15(14)16/h5-7,10-12,18H,4,8-9H2,1-3H3.
What are the key properties of 4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol?
4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol has a molecular weight of 267.34 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-3-fluorophenol is sourced from PubChem (CID 107720941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).