1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one

C13H22N2O4 — CID 114778269

IUPAC1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one
SMILESCC1(C)CN(C(=O)CN2CCCC2=O)CC(CO)O1
InChIInChI=1S/C13H22N2O4/c1-13(2)9-15(6-10(8-16)19-13)12(18)7-14-5-3-4-11(14)17/h10,16H,3-9H2,1-2H3
InChIKeySUCUIEWRFCZTBR-UHFFFAOYSA-N
MW270.33 g/mol
LogP-0.39
Rot. Bonds3

About 1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one

1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one (PubChem CID 114778269) has the molecular formula C13H22N2O4 and a molecular weight of 270.33 g/mol. Its IUPAC name is 1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one
PubChem CID114778269
Molecular FormulaC13H22N2O4
Molecular Weight270.33 g/mol
Exact Mass270.16
IUPAC Name1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one
SMILESCC1(C)CN(C(=O)CN2CCCC2=O)CC(CO)O1
InChIInChI=1S/C13H22N2O4/c1-13(2)9-15(6-10(8-16)19-13)12(18)7-14-5-3-4-11(14)17/h10,16H,3-9H2,1-2H3
InChIKeySUCUIEWRFCZTBR-UHFFFAOYSA-N
XLogP-0.39
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(3,4-dihydroxypyrrolidin-1-yl)-2-oxoethyl]pyrrolidin-2-one
CID 106671974
2-[3-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-3-oxopropyl]sulfanylacetamide
CID 114778946
1-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]pyrrolidin-2-one
CID 115875098
3-amino-1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-4,4-dimethylpentan-1-one
CID 114776669
1-[2-[3-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]pyrrolidin-2-one
CID 63263320
[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-(4-hydroxyphenyl)methanone
CID 114777165
1-[(6R)-6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]prop-2-en-1-one
CID 166408409
1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-3-(oxan-2-yl)propan-1-one
CID 114778648
5-[6-(hydroxymethyl)-2,2-dimethylmorpholine-4-carbonyl]-4,5-dihydro-1,2-oxazole-3-carboxylic acid
CID 107427600
1-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-(2-methylphenyl)sulfanylethanone
CID 114778930
2-methyl-2-[1-[2-(2-oxopyrrolidin-1-yl)acetyl]piperidin-3-yl]propanoic acid
CID 83198658
1-[6-(chloromethyl)-2,2-dimethylmorpholin-4-yl]propan-1-one
CID 114781310

Frequently Asked Questions

What is the IUPAC name of 1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one (CID 114778269) is 1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one is CC1(C)CN(C(=O)CN2CCCC2=O)CC(CO)O1.
What is the InChIKey of 1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one?
The InChIKey is SUCUIEWRFCZTBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O4/c1-13(2)9-15(6-10(8-16)19-13)12(18)7-14-5-3-4-11(14)17/h10,16H,3-9H2,1-2H3.
What are the key properties of 1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one?
1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one has a molecular weight of 270.33 g/mol, XLogP of -0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-2-oxoethyl]pyrrolidin-2-one is sourced from PubChem (CID 114778269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).