1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one

C15H22FN3O2 — CID 63066571

IUPAC1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one
SMILESCCNC(C)c1ccc(F)cc1OCCN1CCNC1=O
InChIInChI=1S/C15H22FN3O2/c1-3-17-11(2)13-5-4-12(16)10-14(13)21-9-8-19-7-6-18-15(19)20/h4-5,10-11,17H,3,6-9H2,1-2H3,(H,18,20)
InChIKeyLVULCYLYZGDMML-UHFFFAOYSA-N
MW295.36 g/mol
LogP1.90
Rot. Bonds7

About 1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one

1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one (PubChem CID 63066571) has the molecular formula C15H22FN3O2 and a molecular weight of 295.36 g/mol. Its IUPAC name is 1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one
PubChem CID63066571
Molecular FormulaC15H22FN3O2
Molecular Weight295.36 g/mol
Exact Mass295.17
IUPAC Name1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one
SMILESCCNC(C)c1ccc(F)cc1OCCN1CCNC1=O
InChIInChI=1S/C15H22FN3O2/c1-3-17-11(2)13-5-4-12(16)10-14(13)21-9-8-19-7-6-18-15(19)20/h4-5,10-11,17H,3,6-9H2,1-2H3,(H,18,20)
InChIKeyLVULCYLYZGDMML-UHFFFAOYSA-N
XLogP1.90
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-[4-fluoro-2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanamine
CID 63065873
1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one
CID 107695464
1-[2-(2-acetyl-5-fluorophenoxy)ethyl]imidazolidin-2-one
CID 55146500
N-ethyl-1-[4-fluoro-2-(3-methylbutoxy)phenyl]ethanamine
CID 63065689
1-[2-(2-ethoxyethoxy)-4-fluorophenyl]-N-ethylethanamine
CID 55180092
N-ethyl-1-[4-fluoro-2-(2-phenylethoxy)phenyl]ethanamine
CID 63066226
N-ethyl-1-[4-fluoro-2-(2-methylpropoxy)phenyl]ethanamine
CID 63066393
N-ethyl-1-[4-fluoro-2-[(4-methylmorpholin-2-yl)methoxy]phenyl]ethanamine
CID 79164229
5-fluoro-2-[2-(2-oxoimidazolidin-1-yl)ethoxy]benzenesulfonamide
CID 62104427
methyl 2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]acetate
CID 63066050
N-ethyl-1-[4-fluoro-2-(2-pyridin-3-ylethoxy)phenyl]ethanamine
CID 63265153
1-[2-(2-fluoro-5-methylphenoxy)ethyl]imidazolidin-2-one
CID 64854131

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one (CID 63066571) is 1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one is CCNC(C)c1ccc(F)cc1OCCN1CCNC1=O.
What is the InChIKey of 1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one?
The InChIKey is LVULCYLYZGDMML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3O2/c1-3-17-11(2)13-5-4-12(16)10-14(13)21-9-8-19-7-6-18-15(19)20/h4-5,10-11,17H,3,6-9H2,1-2H3,(H,18,20).
What are the key properties of 1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one?
1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one has a molecular weight of 295.36 g/mol, XLogP of 1.90, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one is sourced from PubChem (CID 63066571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).