methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate

C13H22N2O5 — CID 115971683

IUPACmethyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate
SMILESCOC(=O)C1CC(O)CN1CC(=O)N1CCOC(C)C1
InChIInChI=1S/C13H22N2O5/c1-9-6-14(3-4-20-9)12(17)8-15-7-10(16)5-11(15)13(18)19-2/h9-11,16H,3-8H2,1-2H3
InChIKeyGLGWEEZIZRCGIW-UHFFFAOYSA-N
MW286.33 g/mol
LogP-1.16
Rot. Bonds3

About methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate

methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate (PubChem CID 115971683) has the molecular formula C13H22N2O5 and a molecular weight of 286.33 g/mol. Its IUPAC name is methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate.

Molecular Properties

Compound Namemethyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate
PubChem CID115971683
Molecular FormulaC13H22N2O5
Molecular Weight286.33 g/mol
Exact Mass286.15
IUPAC Namemethyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate
SMILESCOC(=O)C1CC(O)CN1CC(=O)N1CCOC(C)C1
InChIInChI=1S/C13H22N2O5/c1-9-6-14(3-4-20-9)12(17)8-15-7-10(16)5-11(15)13(18)19-2/h9-11,16H,3-8H2,1-2H3
InChIKeyGLGWEEZIZRCGIW-UHFFFAOYSA-N
XLogP-1.16
TPSA79.31 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 5-1.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 1-[2-(azocan-1-yl)-2-oxoethyl]-4-hydroxypyrrolidine-2-carboxylate
CID 115971582
2-[(2R,5S)-2,5-dimethylmorpholin-4-yl]-1-[(2R)-2-methylmorpholin-4-yl]ethanone
CID 98689719
methyl (2S,4S)-1-(2-chloroprop-2-enyl)-4-hydroxypyrrolidine-2-carboxylate
CID 71850543
methyl 4-hydroxy-1-[2-(methylamino)-2-oxoethyl]pyrrolidine-2-carboxylate
CID 72693049
4-hydroxy-1-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]pyrrolidine-2-carboxylic acid
CID 114351773
2-(azepan-1-yl)-1-[(2S)-2-methylmorpholin-4-yl]ethanone
CID 94823036
2-(azepan-1-yl)-1-(2-methylmorpholin-4-yl)ethanone
CID 51074710
(2S)-2-methylmorpholine-4-carbonyl chloride
CID 151798222
2-[2-(hydroxymethyl)pyrrolidin-1-yl]-1-(2-methylmorpholin-4-yl)ethanone
CID 62015912
[2-(2-methylmorpholin-4-yl)-2-oxoethyl] (2S)-1-(adamantane-1-carbonyl)-4-hydroxypyrrolidine-2-carboxylate
CID 55935853
methyl 4-hydroxy-1-(3-methylbut-2-enyl)pyrrolidine-2-carboxylate
CID 112632759
methyl 1-[2-(dipropylamino)-2-oxoethyl]-4-hydroxypyrrolidine-2-carboxylate
CID 115971555

Frequently Asked Questions

What is the IUPAC name of methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate?
The IUPAC name of methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate (CID 115971683) is methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate.
What is the SMILES notation for methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate?
The canonical SMILES for methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate is COC(=O)C1CC(O)CN1CC(=O)N1CCOC(C)C1.
What is the InChIKey of methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate?
The InChIKey is GLGWEEZIZRCGIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O5/c1-9-6-14(3-4-20-9)12(17)8-15-7-10(16)5-11(15)13(18)19-2/h9-11,16H,3-8H2,1-2H3.
What are the key properties of methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate?
methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate has a molecular weight of 286.33 g/mol, XLogP of -1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-hydroxy-1-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]pyrrolidine-2-carboxylate is sourced from PubChem (CID 115971683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).