2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine

C15H23FN2O — CID 106532708

IUPAC2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine
SMILESCCC1COC(C)CN1c1cc(F)cc(CCN)c1
InChIInChI=1S/C15H23FN2O/c1-3-14-10-19-11(2)9-18(14)15-7-12(4-5-17)6-13(16)8-15/h6-8,11,14H,3-5,9-10,17H2,1-2H3
InChIKeyOOKBUJXMEOVZJZ-UHFFFAOYSA-N
MW266.36 g/mol
LogP2.33
Rot. Bonds4

About 2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine

2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine (PubChem CID 106532708) has the molecular formula C15H23FN2O and a molecular weight of 266.36 g/mol. Its IUPAC name is 2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine.

Molecular Properties

Compound Name2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine
PubChem CID106532708
Molecular FormulaC15H23FN2O
Molecular Weight266.36 g/mol
Exact Mass266.18
IUPAC Name2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine
SMILESCCC1COC(C)CN1c1cc(F)cc(CCN)c1
InChIInChI=1S/C15H23FN2O/c1-3-14-10-19-11(2)9-18(14)15-7-12(4-5-17)6-13(16)8-15/h6-8,11,14H,3-5,9-10,17H2,1-2H3
InChIKeyOOKBUJXMEOVZJZ-UHFFFAOYSA-N
XLogP2.33
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine?
The IUPAC name of 2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine (CID 106532708) is 2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine.
What is the SMILES notation for 2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine?
The canonical SMILES for 2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine is CCC1COC(C)CN1c1cc(F)cc(CCN)c1.
What is the InChIKey of 2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine?
The InChIKey is OOKBUJXMEOVZJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O/c1-3-14-10-19-11(2)9-18(14)15-7-12(4-5-17)6-13(16)8-15/h6-8,11,14H,3-5,9-10,17H2,1-2H3.
What are the key properties of 2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine?
2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine has a molecular weight of 266.36 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(5-ethyl-2-methylmorpholin-4-yl)-5-fluorophenyl]ethanamine is sourced from PubChem (CID 106532708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).