2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone

C18H17F2NO2 — CID 110663780

IUPAC2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone
SMILESO=C(Cc1ccccc1F)N1CCOC(c2ccccc2F)C1
InChIInChI=1S/C18H17F2NO2/c19-15-7-3-1-5-13(15)11-18(22)21-9-10-23-17(12-21)14-6-2-4-8-16(14)20/h1-8,17H,9-12H2
InChIKeyGJYBAJUOCMVPKA-UHFFFAOYSA-N
MW317.34 g/mol
LogP3.11
Rot. Bonds3

About 2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone

2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone (PubChem CID 110663780) has the molecular formula C18H17F2NO2 and a molecular weight of 317.34 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone
PubChem CID110663780
Molecular FormulaC18H17F2NO2
Molecular Weight317.34 g/mol
Exact Mass317.12
IUPAC Name2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone
SMILESO=C(Cc1ccccc1F)N1CCOC(c2ccccc2F)C1
InChIInChI=1S/C18H17F2NO2/c19-15-7-3-1-5-13(15)11-18(22)21-9-10-23-17(12-21)14-6-2-4-8-16(14)20/h1-8,17H,9-12H2
InChIKeyGJYBAJUOCMVPKA-UHFFFAOYSA-N
XLogP3.11
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.34
LogP ≤ 53.11
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-[2-(2-fluorophenyl)morpholin-4-yl]ethanone?
The IUPAC name of 2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone (CID 110663780) is 2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone.
What is the SMILES notation for 2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone?
The canonical SMILES for 2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone is O=C(Cc1ccccc1F)N1CCOC(c2ccccc2F)C1.
What is the InChIKey of 2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone?
The InChIKey is GJYBAJUOCMVPKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F2NO2/c19-15-7-3-1-5-13(15)11-18(22)21-9-10-23-17(12-21)14-6-2-4-8-16(14)20/h1-8,17H,9-12H2.
What are the key properties of 2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone?
2-(2-fluorophenyl)-1-[2-(2-fluorophenyl)morpholin-4-yl]ethanone has a molecular weight of 317.34 g/mol, XLogP of 3.11, 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-[2-(2-fluorophenyl)morpholin-4-yl]ethanone is sourced from PubChem (CID 110663780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).