3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione

C11H19N3O3 — CID 79078126

IUPAC3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione
SMILESCC1NC(=O)CN(CC2CN(C)CCO2)C1=O
InChIInChI=1S/C11H19N3O3/c1-8-11(16)14(7-10(15)12-8)6-9-5-13(2)3-4-17-9/h8-9H,3-7H2,1-2H3,(H,12,15)
InChIKeyMSWYEYDZDFNUIW-UHFFFAOYSA-N
MW241.29 g/mol
LogP-1.34
Rot. Bonds2

About 3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione

3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione (PubChem CID 79078126) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione.

Molecular Properties

Compound Name3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione
PubChem CID79078126
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione
SMILESCC1NC(=O)CN(CC2CN(C)CCO2)C1=O
InChIInChI=1S/C11H19N3O3/c1-8-11(16)14(7-10(15)12-8)6-9-5-13(2)3-4-17-9/h8-9H,3-7H2,1-2H3,(H,12,15)
InChIKeyMSWYEYDZDFNUIW-UHFFFAOYSA-N
XLogP-1.34
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-1.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyclopropyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione
CID 79077020
1-[(4-methylmorpholin-2-yl)methyl]-1,3-diazinane-2,4-dione
CID 79777308
5-methyl-1-[(4-methylmorpholin-2-yl)methyl]-1,3-diazinane-2,4-dione
CID 79777205
4-hydroxy-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one
CID 79071600
3-(ethylamino)-1-[(4-methylmorpholin-2-yl)methyl]pyrrolidin-2-one
CID 79071630
5-methyl-3-[(4-methylmorpholin-2-yl)methyl]-2-propylimidazolidin-4-one
CID 83259028
3-[(4-methylmorpholin-2-yl)methyl]imidazolidine-2,4-dione
CID 103936187
3-methyl-1-[3-(oxolan-2-yl)propyl]piperazine-2,5-dione
CID 65170302
10-[(4-methylmorpholin-2-yl)methyl]-6,10-diazaspiro[4.6]undecane-7,11-dione
CID 79071288
3-methyl-2-[(4-methylmorpholin-2-yl)methyl]-3,6,7,8,9,9a-hexahydropyrido[1,2-a]pyrazine-1,4-dione
CID 79916937
1-[(4-methylmorpholin-2-yl)methyl]-5-oxopyrrolidine-3-carbonitrile
CID 79071401
1-[(4-methylmorpholin-2-yl)methyl]pyridin-4-one
CID 116622203

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione?
The IUPAC name of 3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione (CID 79078126) is 3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione.
What is the SMILES notation for 3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione?
The canonical SMILES for 3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione is CC1NC(=O)CN(CC2CN(C)CCO2)C1=O.
What is the InChIKey of 3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione?
The InChIKey is MSWYEYDZDFNUIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-8-11(16)14(7-10(15)12-8)6-9-5-13(2)3-4-17-9/h8-9H,3-7H2,1-2H3,(H,12,15).
What are the key properties of 3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione?
3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione has a molecular weight of 241.29 g/mol, XLogP of -1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[(4-methylmorpholin-2-yl)methyl]piperazine-2,5-dione is sourced from PubChem (CID 79078126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).