4-benzyl-3-(4-fluorophenyl)morpholine

C17H18FNO — CID 57212944

IUPAC4-benzyl-3-(4-fluorophenyl)morpholine
SMILESFc1ccc(C2COCCN2Cc2ccccc2)cc1
InChIInChI=1S/C17H18FNO/c18-16-8-6-15(7-9-16)17-13-20-11-10-19(17)12-14-4-2-1-3-5-14/h1-9,17H,10-13H2
InChIKeyJROKUIHTHNIPSF-UHFFFAOYSA-N
MW271.34 g/mol
LogP3.40
Rot. Bonds3

About 4-benzyl-3-(4-fluorophenyl)morpholine

4-benzyl-3-(4-fluorophenyl)morpholine (PubChem CID 57212944) has the molecular formula C17H18FNO and a molecular weight of 271.34 g/mol. Its IUPAC name is 4-benzyl-3-(4-fluorophenyl)morpholine.

Molecular Properties

Compound Name4-benzyl-3-(4-fluorophenyl)morpholine
PubChem CID57212944
Molecular FormulaC17H18FNO
Molecular Weight271.34 g/mol
Exact Mass271.14
IUPAC Name4-benzyl-3-(4-fluorophenyl)morpholine
SMILESFc1ccc(C2COCCN2Cc2ccccc2)cc1
InChIInChI=1S/C17H18FNO/c18-16-8-6-15(7-9-16)17-13-20-11-10-19(17)12-14-4-2-1-3-5-14/h1-9,17H,10-13H2
InChIKeyJROKUIHTHNIPSF-UHFFFAOYSA-N
XLogP3.40
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-3-(4-fluorophenyl)morpholine?
The IUPAC name of 4-benzyl-3-(4-fluorophenyl)morpholine (CID 57212944) is 4-benzyl-3-(4-fluorophenyl)morpholine.
What is the SMILES notation for 4-benzyl-3-(4-fluorophenyl)morpholine?
The canonical SMILES for 4-benzyl-3-(4-fluorophenyl)morpholine is Fc1ccc(C2COCCN2Cc2ccccc2)cc1.
What is the InChIKey of 4-benzyl-3-(4-fluorophenyl)morpholine?
The InChIKey is JROKUIHTHNIPSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO/c18-16-8-6-15(7-9-16)17-13-20-11-10-19(17)12-14-4-2-1-3-5-14/h1-9,17H,10-13H2.
What are the key properties of 4-benzyl-3-(4-fluorophenyl)morpholine?
4-benzyl-3-(4-fluorophenyl)morpholine has a molecular weight of 271.34 g/mol, XLogP of 3.40, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-3-(4-fluorophenyl)morpholine is sourced from PubChem (CID 57212944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).