1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one

C14H21N3O3 — CID 43278574

IUPAC1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one
SMILESCNCc1ccc(OCCN2CCNC2=O)c(OC)c1
InChIInChI=1S/C14H21N3O3/c1-15-10-11-3-4-12(13(9-11)19-2)20-8-7-17-6-5-16-14(17)18/h3-4,9,15H,5-8,10H2,1-2H3,(H,16,18)
InChIKeyWIOQYNSBWCMRTC-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.82
Rot. Bonds7

About 1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one

1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one (PubChem CID 43278574) has the molecular formula C14H21N3O3 and a molecular weight of 279.34 g/mol. Its IUPAC name is 1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one
PubChem CID43278574
Molecular FormulaC14H21N3O3
Molecular Weight279.34 g/mol
Exact Mass279.16
IUPAC Name1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one
SMILESCNCc1ccc(OCCN2CCNC2=O)c(OC)c1
InChIInChI=1S/C14H21N3O3/c1-15-10-11-3-4-12(13(9-11)19-2)20-8-7-17-6-5-16-14(17)18/h3-4,9,15H,5-8,10H2,1-2H3,(H,16,18)
InChIKeyWIOQYNSBWCMRTC-UHFFFAOYSA-N
XLogP0.82
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[2-methoxy-4-(oxidoamino)phenoxy]ethyl]imidazolidin-2-one
CID 146830978
1-[2-[5-(methylaminomethyl)-2-nitrophenoxy]ethyl]imidazolidin-2-one
CID 62115331
1-[2-[2-ethoxy-4-(hydroxymethyl)phenoxy]ethyl]imidazolidin-2-one
CID 28561686
1-[2-[[6-methyl-2-(methylaminomethyl)-3-pyridinyl]oxy]ethyl]imidazolidin-2-one
CID 79151657
3-ethoxy-4-[2-(2-oxoimidazolidin-1-yl)ethoxy]benzonitrile
CID 61388215
1-[2-[2-(ethylaminomethyl)-4-fluorophenoxy]ethyl]imidazolidin-2-one
CID 107695464
1-[2-(1-methoxynaphthalen-2-yl)oxyethyl]imidazolidin-2-one
CID 137399955
1-[4-(2-ethylsulfonylethoxy)-3-methoxyphenyl]-N-methylmethanamine
CID 43807425
1-[4-methoxy-3-[2-(2-methylpyrazol-3-yl)ethoxy]phenyl]-N-methylmethanamine
CID 102999612
1-[2-[2-(hydroxymethyl)-4-methylphenoxy]ethyl]imidazolidin-2-one
CID 63325459
1-(4-methoxy-3-propoxyphenyl)-N-methylmethanamine
CID 15079025
1-[4-(2-tert-butylsulfonylethoxy)-3-methoxyphenyl]-N-methylmethanamine
CID 106722034

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one (CID 43278574) is 1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one is CNCc1ccc(OCCN2CCNC2=O)c(OC)c1.
What is the InChIKey of 1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one?
The InChIKey is WIOQYNSBWCMRTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3/c1-15-10-11-3-4-12(13(9-11)19-2)20-8-7-17-6-5-16-14(17)18/h3-4,9,15H,5-8,10H2,1-2H3,(H,16,18).
What are the key properties of 1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one?
1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one has a molecular weight of 279.34 g/mol, XLogP of 0.82, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-methoxy-4-(methylaminomethyl)phenoxy]ethyl]imidazolidin-2-one is sourced from PubChem (CID 43278574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).