1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one

C14H20FN3O2 — CID 107695464

IUPAC1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one
SMILESCCNCc1cc(F)ccc1OCCN1CCNC1=O
InChIInChI=1S/C14H20FN3O2/c1-2-16-10-11-9-12(15)3-4-13(11)20-8-7-18-6-5-17-14(18)19/h3-4,9,16H,2,5-8,10H2,1H3,(H,17,19)
InChIKeyWLZOZJVNUYHKLF-UHFFFAOYSA-N
MW281.33 g/mol
LogP1.34
Rot. Bonds7

About 1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one

1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one (PubChem CID 107695464) has the molecular formula C14H20FN3O2 and a molecular weight of 281.33 g/mol. Its IUPAC name is 1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one
PubChem CID107695464
Molecular FormulaC14H20FN3O2
Molecular Weight281.33 g/mol
Exact Mass281.15
IUPAC Name1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one
SMILESCCNCc1cc(F)ccc1OCCN1CCNC1=O
InChIInChI=1S/C14H20FN3O2/c1-2-16-10-11-9-12(15)3-4-13(11)20-8-7-18-6-5-17-14(18)19/h3-4,9,16H,2,5-8,10H2,1H3,(H,17,19)
InChIKeyWLZOZJVNUYHKLF-UHFFFAOYSA-N
XLogP1.34
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[2-[1-(ethylamino)ethyl]-5-fluorophenoxy]ethyl]imidazolidin-2-one
CID 63066571
1-[2-(2-acetyl-5-fluorophenoxy)ethyl]imidazolidin-2-one
CID 55146500
5-fluoro-2-[2-(2-oxoimidazolidin-1-yl)ethoxy]benzenesulfonamide
CID 62104427
1-[2-[2-(hydroxymethyl)-4-methylphenoxy]ethyl]imidazolidin-2-one
CID 63325459
1-[2-[4-chloro-2-[(propan-2-ylamino)methyl]phenoxy]ethyl]imidazolidin-2-one
CID 43278045
1-[2-[4-bromo-2-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one
CID 28981461
1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one
CID 43278574
1-[2-[4-bromo-2-[(cyclopropylamino)methyl]phenoxy]ethyl]imidazolidin-2-one
CID 43277658
1-[2-(2-fluoro-5-methylphenoxy)ethyl]imidazolidin-2-one
CID 64854131
1-[2-[2-methoxy-4-(oxidoamino)phenoxy]ethyl]imidazolidin-2-one
CID 146830978
1-[2-[2-ethoxy-4-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one
CID 28561686
5-[[2-(ethylaminomethyl)-4-fluorophenoxy]methyl]-1,3-oxazolidin-2-one
CID 107695754

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one (CID 107695464) is 1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one is CCNCc1cc(F)ccc1OCCN1CCNC1=O.
What is the InChIKey of 1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one?
The InChIKey is WLZOZJVNUYHKLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O2/c1-2-16-10-11-9-12(15)3-4-13(11)20-8-7-18-6-5-17-14(18)19/h3-4,9,16H,2,5-8,10H2,1H3,(H,17,19).
What are the key properties of 1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one?
1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one has a molecular weight of 281.33 g/mol, XLogP of 1.34, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one is sourced from PubChem (CID 107695464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).