4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine

C14H20FNO2 — CID 102990646

IUPAC4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine
SMILESCCN1CCOC(COc2cc(F)ccc2C)C1
InChIInChI=1S/C14H20FNO2/c1-3-16-6-7-17-13(9-16)10-18-14-8-12(15)5-4-11(14)2/h4-5,8,13H,3,6-7,9-10H2,1-2H3
InChIKeyOFQBAIZSAHNEIG-UHFFFAOYSA-N
MW253.32 g/mol
LogP2.23
Rot. Bonds4

About 4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine

4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine (PubChem CID 102990646) has the molecular formula C14H20FNO2 and a molecular weight of 253.32 g/mol. Its IUPAC name is 4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine.

Molecular Properties

Compound Name4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine
PubChem CID102990646
Molecular FormulaC14H20FNO2
Molecular Weight253.32 g/mol
Exact Mass253.15
IUPAC Name4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine
SMILESCCN1CCOC(COc2cc(F)ccc2C)C1
InChIInChI=1S/C14H20FNO2/c1-3-16-6-7-17-13(9-16)10-18-14-8-12(15)5-4-11(14)2/h4-5,8,13H,3,6-7,9-10H2,1-2H3
InChIKeyOFQBAIZSAHNEIG-UHFFFAOYSA-N
XLogP2.23
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(4-ethylmorpholin-2-yl)methoxy]-4-methylaniline
CID 79166695
(2R)-2-[(2-bromophenoxy)methyl]-4-ethylmorpholine
CID 97154192
(2S)-2-[(2-bromophenoxy)methyl]-4-ethylmorpholine
CID 97154191
2-[4-[(4-ethylmorpholin-2-yl)methoxy]-3-fluorophenyl]ethanamine
CID 107692794
5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline
CID 114252444
[2-[(4-ethylmorpholin-2-yl)methoxy]phenyl]methanamine
CID 79166316
1-[2-[(4-ethylmorpholin-2-yl)methoxy]-5-methoxyphenyl]-N-methylmethanamine
CID 79165518
(1R)-1-[2-[(4-ethylmorpholin-2-yl)methoxy]phenyl]ethanol
CID 79171283
1-(4-ethylmorpholin-2-yl)-N-[(5-fluoro-2-methylphenyl)methyl]methanamine
CID 115968124
5-bromo-2-[(4-ethylmorpholin-2-yl)methoxy]aniline
CID 79167033
1-[3-[(4-ethylmorpholin-2-yl)methoxy]-6-methyl-2-pyridinyl]-N-methylmethanamine
CID 79167041
4-[(4-ethylmorpholin-2-yl)methoxy]-3-fluorobenzenecarboximidamide
CID 107666488

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine?
The IUPAC name of 4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine (CID 102990646) is 4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine.
What is the SMILES notation for 4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine?
The canonical SMILES for 4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine is CCN1CCOC(COc2cc(F)ccc2C)C1.
What is the InChIKey of 4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine?
The InChIKey is OFQBAIZSAHNEIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO2/c1-3-16-6-7-17-13(9-16)10-18-14-8-12(15)5-4-11(14)2/h4-5,8,13H,3,6-7,9-10H2,1-2H3.
What are the key properties of 4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine?
4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine has a molecular weight of 253.32 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine is sourced from PubChem (CID 102990646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).