methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate

C11H20N2O4 — CID 51081735

IUPACmethyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate
SMILESCOC(=O)N(C)CC(=O)N1CC(C)OCC1C
InChIInChI=1S/C11H20N2O4/c1-8-7-17-9(2)5-13(8)10(14)6-12(3)11(15)16-4/h8-9H,5-7H2,1-4H3
InChIKeyBOHHAEUSBBMFNX-UHFFFAOYSA-N
MW244.29 g/mol
LogP0.32
Rot. Bonds2

About methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate

methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate (PubChem CID 51081735) has the molecular formula C11H20N2O4 and a molecular weight of 244.29 g/mol. Its IUPAC name is methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate.

Molecular Properties

Compound Namemethyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate
PubChem CID51081735
Molecular FormulaC11H20N2O4
Molecular Weight244.29 g/mol
Exact Mass244.14
IUPAC Namemethyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate
SMILESCOC(=O)N(C)CC(=O)N1CC(C)OCC1C
InChIInChI=1S/C11H20N2O4/c1-8-7-17-9(2)5-13(8)10(14)6-12(3)11(15)16-4/h8-9H,5-7H2,1-4H3
InChIKeyBOHHAEUSBBMFNX-UHFFFAOYSA-N
XLogP0.32
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-2-oxoethyl]-N-methylmethanesulfonamide
CID 94093975
3-[(2,5-dimethylmorpholine-4-carbonyl)-methylamino]propanoic acid
CID 61200735
1-(2,5-dimethylmorpholin-4-yl)-4-(methylamino)butan-1-one
CID 60842405
1-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-2-methylsulfanylethanone
CID 94053963
1-[(2S,5S)-2,5-dimethylmorpholin-4-yl]-2-methylsulfanylethanone
CID 94053964
1-(2,5-dimethylmorpholin-4-yl)-4-(methylamino)butan-1-one;hydrochloride
CID 119729187
1-[(2R,5S)-2,5-dimethylmorpholin-4-yl]octan-1-one
CID 98368513
2-cyclopentyl-1-[(2S,5S)-2,5-dimethylmorpholin-4-yl]ethanone
CID 95157279
N-[6-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-6-oxohexyl]acetamide
CID 94053945
1-(2,5-dimethylmorpholin-4-yl)-2,2-difluoroethanone
CID 103515326
4-[3-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-3-oxopropyl]benzoic acid
CID 124693867
2-[4-(aminomethyl)phenyl]-1-(2,5-dimethylmorpholin-4-yl)ethanone
CID 55213909

Frequently Asked Questions

What is the IUPAC name of methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate?
The IUPAC name of methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate (CID 51081735) is methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate.
What is the SMILES notation for methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate?
The canonical SMILES for methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate is COC(=O)N(C)CC(=O)N1CC(C)OCC1C.
What is the InChIKey of methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate?
The InChIKey is BOHHAEUSBBMFNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4/c1-8-7-17-9(2)5-13(8)10(14)6-12(3)11(15)16-4/h8-9H,5-7H2,1-4H3.
What are the key properties of methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate?
methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate has a molecular weight of 244.29 g/mol, XLogP of 0.32, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-N-methylcarbamate is sourced from PubChem (CID 51081735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).