3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine

C18H20FNO — CID 142102089

IUPAC3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine
SMILESC[C@H](c1ccccc1)N1CCOCC1c1ccc(F)cc1
InChIInChI=1S/C18H20FNO/c1-14(15-5-3-2-4-6-15)20-11-12-21-13-18(20)16-7-9-17(19)10-8-16/h2-10,14,18H,11-13H2,1H3/t14-,18?/m1/s1
InChIKeyGNRJTTLICAVBJP-IKJXHCRLSA-N
MW285.36 g/mol
LogP3.96
Rot. Bonds3

About 3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine

3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine (PubChem CID 142102089) has the molecular formula C18H20FNO and a molecular weight of 285.36 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine
PubChem CID142102089
Molecular FormulaC18H20FNO
Molecular Weight285.36 g/mol
Exact Mass285.15
IUPAC Name3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine
SMILESC[C@H](c1ccccc1)N1CCOCC1c1ccc(F)cc1
InChIInChI=1S/C18H20FNO/c1-14(15-5-3-2-4-6-15)20-11-12-21-13-18(20)16-7-9-17(19)10-8-16/h2-10,14,18H,11-13H2,1H3/t14-,18?/m1/s1
InChIKeyGNRJTTLICAVBJP-IKJXHCRLSA-N
XLogP3.96
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine?
The IUPAC name of 3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine (CID 142102089) is 3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine.
What is the SMILES notation for 3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine?
The canonical SMILES for 3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine is C[C@H](c1ccccc1)N1CCOCC1c1ccc(F)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine?
The InChIKey is GNRJTTLICAVBJP-IKJXHCRLSA-N. The full InChI is InChI=1S/C18H20FNO/c1-14(15-5-3-2-4-6-15)20-11-12-21-13-18(20)16-7-9-17(19)10-8-16/h2-10,14,18H,11-13H2,1H3/t14-,18?/m1/s1.
What are the key properties of 3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine?
3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine has a molecular weight of 285.36 g/mol, XLogP of 3.96, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-4-[(1R)-1-phenylethyl]morpholine is sourced from PubChem (CID 142102089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).