4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine

C17H18FNO2 — CID 131890518

IUPAC4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine
SMILESCOc1ccc(F)cc1-c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C17H18FNO2/c1-20-17-7-4-14(18)12-16(17)13-2-5-15(6-3-13)19-8-10-21-11-9-19/h2-7,12H,8-11H2,1H3
InChIKeyKZTAPYJPEOAJQM-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.34
Rot. Bonds3

About 4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine

4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine (PubChem CID 131890518) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is 4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine.

Molecular Properties

Compound Name4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine
PubChem CID131890518
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC Name4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine
SMILESCOc1ccc(F)cc1-c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C17H18FNO2/c1-20-17-7-4-14(18)12-16(17)13-2-5-15(6-3-13)19-8-10-21-11-9-19/h2-7,12H,8-11H2,1H3
InChIKeyKZTAPYJPEOAJQM-UHFFFAOYSA-N
XLogP3.34
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine?
The IUPAC name of 4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine (CID 131890518) is 4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine.
What is the SMILES notation for 4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine?
The canonical SMILES for 4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine is COc1ccc(F)cc1-c1ccc(N2CCOCC2)cc1.
What is the InChIKey of 4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine?
The InChIKey is KZTAPYJPEOAJQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-20-17-7-4-14(18)12-16(17)13-2-5-15(6-3-13)19-8-10-21-11-9-19/h2-7,12H,8-11H2,1H3.
What are the key properties of 4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine?
4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine has a molecular weight of 287.33 g/mol, XLogP of 3.34, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(5-fluoro-2-methoxyphenyl)phenyl]morpholine is sourced from PubChem (CID 131890518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).