2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one

C15H21FN2O2 — CID 43084408

IUPAC2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one
SMILESCC(NCCc1ccccc1F)C(=O)N1CCOCC1
InChIInChI=1S/C15H21FN2O2/c1-12(15(19)18-8-10-20-11-9-18)17-7-6-13-4-2-3-5-14(13)16/h2-5,12,17H,6-11H2,1H3
InChIKeyIGTHOKRSCAQFNS-UHFFFAOYSA-N
MW280.34 g/mol
LogP1.21
Rot. Bonds5

About 2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one

2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one (PubChem CID 43084408) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is 2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one
PubChem CID43084408
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC Name2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one
SMILESCC(NCCc1ccccc1F)C(=O)N1CCOCC1
InChIInChI=1S/C15H21FN2O2/c1-12(15(19)18-8-10-20-11-9-18)17-7-6-13-4-2-3-5-14(13)16/h2-5,12,17H,6-11H2,1H3
InChIKeyIGTHOKRSCAQFNS-UHFFFAOYSA-N
XLogP1.21
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one (CID 43084408) is 2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one is CC(NCCc1ccccc1F)C(=O)N1CCOCC1.
What is the InChIKey of 2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one?
The InChIKey is IGTHOKRSCAQFNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-12(15(19)18-8-10-20-11-9-18)17-7-6-13-4-2-3-5-14(13)16/h2-5,12,17H,6-11H2,1H3.
What are the key properties of 2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one?
2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one has a molecular weight of 280.34 g/mol, XLogP of 1.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-fluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 43084408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).