2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone

C18H18FNO2 — CID 110728374

IUPAC2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone
SMILESO=C(Cc1ccccc1F)N1CCOCC1c1ccccc1
InChIInChI=1S/C18H18FNO2/c19-16-9-5-4-8-15(16)12-18(21)20-10-11-22-13-17(20)14-6-2-1-3-7-14/h1-9,17H,10-13H2
InChIKeyUYLDUYBTQGPSNM-UHFFFAOYSA-N
MW299.35 g/mol
LogP2.97
Rot. Bonds3

About 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone

2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone (PubChem CID 110728374) has the molecular formula C18H18FNO2 and a molecular weight of 299.35 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone.

Molecular Properties

Compound Name2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone
PubChem CID110728374
Molecular FormulaC18H18FNO2
Molecular Weight299.35 g/mol
Exact Mass299.13
IUPAC Name2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone
SMILESO=C(Cc1ccccc1F)N1CCOCC1c1ccccc1
InChIInChI=1S/C18H18FNO2/c19-16-9-5-4-8-15(16)12-18(21)20-10-11-22-13-17(20)14-6-2-1-3-7-14/h1-9,17H,10-13H2
InChIKeyUYLDUYBTQGPSNM-UHFFFAOYSA-N
XLogP2.97
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.35
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone?
The IUPAC name of 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone (CID 110728374) is 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone.
What is the SMILES notation for 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone?
The canonical SMILES for 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone is O=C(Cc1ccccc1F)N1CCOCC1c1ccccc1.
What is the InChIKey of 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone?
The InChIKey is UYLDUYBTQGPSNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FNO2/c19-16-9-5-4-8-15(16)12-18(21)20-10-11-22-13-17(20)14-6-2-1-3-7-14/h1-9,17H,10-13H2.
What are the key properties of 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone?
2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone has a molecular weight of 299.35 g/mol, XLogP of 2.97, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-1-(3-phenylmorpholin-4-yl)ethanone is sourced from PubChem (CID 110728374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).