5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one

C15H22N2O4 — CID 60881929

IUPAC5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one
SMILESCCNC(C)c1ccc(OCC2CNC(=O)O2)c(OC)c1
InChIInChI=1S/C15H22N2O4/c1-4-16-10(2)11-5-6-13(14(7-11)19-3)20-9-12-8-17-15(18)21-12/h5-7,10,12,16H,4,8-9H2,1-3H3,(H,17,18)
InChIKeyMWRXKPBAJUJUFN-UHFFFAOYSA-N
MW294.35 g/mol
LogP1.85
Rot. Bonds7

About 5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one

5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one (PubChem CID 60881929) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one
PubChem CID60881929
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one
SMILESCCNC(C)c1ccc(OCC2CNC(=O)O2)c(OC)c1
InChIInChI=1S/C15H22N2O4/c1-4-16-10(2)11-5-6-13(14(7-11)19-3)20-9-12-8-17-15(18)21-12/h5-7,10,12,16H,4,8-9H2,1-3H3,(H,17,18)
InChIKeyMWRXKPBAJUJUFN-UHFFFAOYSA-N
XLogP1.85
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[[4-chloro-2-[1-(ethylamino)ethyl]phenoxy]methyl]-1,3-oxazolidin-2-one
CID 62073547
5-[[2-[1-(ethylamino)ethyl]-5-methylphenoxy]methyl]-1,3-oxazolidin-2-one
CID 63640817
CID 66849130
CID 66849130
5-[[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]methyl]-1,3-oxazolidin-2-one
CID 134123269
5-[(5-chloro-2-methoxyphenoxy)methyl]-1,3-oxazolidin-2-one
CID 21496492
methanesulfonic acid;5-[(2-methoxyphenoxy)methyl]-1,3-oxazolidin-2-one
CID 87722700
5-[[2-(ethylaminomethyl)-4-fluorophenoxy]methyl]-1,3-oxazolidin-2-one
CID 107695754
N-ethyl-1-[3-methoxy-4-(3-methylsulfonylpropoxy)phenyl]ethanamine
CID 63190643
N-ethyl-1-[3-methoxy-4-(3-methylbutoxy)phenyl]ethanamine
CID 43279451
5-[[4-[2-(ethylamino)propyl]phenoxy]methyl]-1,3-oxazolidin-2-one
CID 115494942
5-[[4-chloro-2-[(1R)-1-hydroxyethyl]phenoxy]methyl]-1,3-oxazolidin-2-one
CID 63364467
5-[[2-ethoxy-4-(methylaminomethyl)phenoxy]methyl]-1,3-oxazolidin-2-one
CID 60880902

Frequently Asked Questions

What is the IUPAC name of 5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one?
The IUPAC name of 5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one (CID 60881929) is 5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one is CCNC(C)c1ccc(OCC2CNC(=O)O2)c(OC)c1.
What is the InChIKey of 5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one?
The InChIKey is MWRXKPBAJUJUFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-4-16-10(2)11-5-6-13(14(7-11)19-3)20-9-12-8-17-15(18)21-12/h5-7,10,12,16H,4,8-9H2,1-3H3,(H,17,18).
What are the key properties of 5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one?
5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one has a molecular weight of 294.35 g/mol, XLogP of 1.85, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[4-[1-(ethylamino)ethyl]-2-methoxyphenoxy]methyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 60881929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).