1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one

C11H21N3O2 — CID 56773839

IUPAC1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one
SMILESC[C@@H]1CN(CCN2CCNC2=O)C[C@H](C)O1
InChIInChI=1S/C11H21N3O2/c1-9-7-13(8-10(2)16-9)5-6-14-4-3-12-11(14)15/h9-10H,3-8H2,1-2H3,(H,12,15)/t9-,10+
InChIKeyLXYMRHYTKMAIJA-AOOOYVTPSA-N
MW227.31 g/mol
LogP0.12
Rot. Bonds3

About 1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one

1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one (PubChem CID 56773839) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is 1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one
PubChem CID56773839
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one
SMILESC[C@@H]1CN(CCN2CCNC2=O)C[C@H](C)O1
InChIInChI=1S/C11H21N3O2/c1-9-7-13(8-10(2)16-9)5-6-14-4-3-12-11(14)15/h9-10H,3-8H2,1-2H3,(H,12,15)/t9-,10+
InChIKeyLXYMRHYTKMAIJA-AOOOYVTPSA-N
XLogP0.12
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one (CID 56773839) is 1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one is C[C@@H]1CN(CCN2CCNC2=O)C[C@H](C)O1.
What is the InChIKey of 1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one?
The InChIKey is LXYMRHYTKMAIJA-AOOOYVTPSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-9-7-13(8-10(2)16-9)5-6-14-4-3-12-11(14)15/h9-10H,3-8H2,1-2H3,(H,12,15)/t9-,10+.
What are the key properties of 1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one?
1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one has a molecular weight of 227.31 g/mol, XLogP of 0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethyl]imidazolidin-2-one is sourced from PubChem (CID 56773839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).