1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone

C12H14FNO2 — CID 110663815

IUPAC1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone
SMILESCC(=O)N1CCOCC1c1ccc(F)cc1
InChIInChI=1S/C12H14FNO2/c1-9(15)14-6-7-16-8-12(14)10-2-4-11(13)5-3-10/h2-5,12H,6-8H2,1H3
InChIKeyDNTQZPYBILPKNK-UHFFFAOYSA-N
MW223.25 g/mol
LogP1.75
Rot. Bonds1

About 1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone

1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone (PubChem CID 110663815) has the molecular formula C12H14FNO2 and a molecular weight of 223.25 g/mol. Its IUPAC name is 1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone.

Molecular Properties

Compound Name1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone
PubChem CID110663815
Molecular FormulaC12H14FNO2
Molecular Weight223.25 g/mol
Exact Mass223.10
IUPAC Name1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone
SMILESCC(=O)N1CCOCC1c1ccc(F)cc1
InChIInChI=1S/C12H14FNO2/c1-9(15)14-6-7-16-8-12(14)10-2-4-11(13)5-3-10/h2-5,12H,6-8H2,1H3
InChIKeyDNTQZPYBILPKNK-UHFFFAOYSA-N
XLogP1.75
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 53625300
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Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone?
The IUPAC name of 1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone (CID 110663815) is 1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone.
What is the SMILES notation for 1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone?
The canonical SMILES for 1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone is CC(=O)N1CCOCC1c1ccc(F)cc1.
What is the InChIKey of 1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone?
The InChIKey is DNTQZPYBILPKNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO2/c1-9(15)14-6-7-16-8-12(14)10-2-4-11(13)5-3-10/h2-5,12H,6-8H2,1H3.
What are the key properties of 1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone?
1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone has a molecular weight of 223.25 g/mol, XLogP of 1.75, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-fluorophenyl)morpholin-4-yl]ethanone is sourced from PubChem (CID 110663815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).