2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone

C13H25N3O3 — CID 131914885

IUPAC2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone
SMILESCOCCC1CN(CC(=O)N2CCNCC2)CCO1
InChIInChI=1S/C13H25N3O3/c1-18-8-2-12-10-15(7-9-19-12)11-13(17)16-5-3-14-4-6-16/h12,14H,2-11H2,1H3
InChIKeyZCXJTWIYFOIDHU-UHFFFAOYSA-N
MW271.36 g/mol
LogP-0.84
Rot. Bonds5

About 2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone

2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone (PubChem CID 131914885) has the molecular formula C13H25N3O3 and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone.

Molecular Properties

Compound Name2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone
PubChem CID131914885
Molecular FormulaC13H25N3O3
Molecular Weight271.36 g/mol
Exact Mass271.19
IUPAC Name2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone
SMILESCOCCC1CN(CC(=O)N2CCNCC2)CCO1
InChIInChI=1S/C13H25N3O3/c1-18-8-2-12-10-15(7-9-19-12)11-13(17)16-5-3-14-4-6-16/h12,14H,2-11H2,1H3
InChIKeyZCXJTWIYFOIDHU-UHFFFAOYSA-N
XLogP-0.84
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 5-0.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(hydroxymethyl)morpholin-4-yl]-1-pyrrolidin-1-ylethanone
CID 79840662
1-(azetidin-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone
CID 79832857
1-(azepan-1-yl)-2-[2-(hydroxymethyl)morpholin-4-yl]ethanone
CID 79833113
1-(2-ethylmorpholin-4-yl)-2-piperazin-1-ylethanone
CID 43563037
1-(4-acetylpiperazin-1-yl)-2-[2-(aminomethyl)morpholin-4-yl]ethanone
CID 114395313
3-[4-(2-methoxyethyl)morpholin-2-yl]propanoic acid
CID 117008804
2-(3-methylpyrrolidin-1-yl)-1-piperazin-1-ylethanone
CID 61226175
2-[2-(hydroxymethyl)morpholin-4-yl]-N-(3-methoxypropyl)acetamide
CID 79840477
3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]-1-piperazin-1-ylpropan-1-one
CID 163402844
1-(1,4-diazepan-1-yl)-2-(3,4-dimethylpiperazin-1-yl)ethanone
CID 63611089
(2S)-4-[(E)-3-(furan-2-yl)-2-methylprop-2-enyl]-2-(2-methoxyethyl)morpholine
CID 95147358
1-piperazin-1-yl-2-pyrrolidin-1-ylethanone
CID 13057079

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone?
The IUPAC name of 2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone (CID 131914885) is 2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone.
What is the SMILES notation for 2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone?
The canonical SMILES for 2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone is COCCC1CN(CC(=O)N2CCNCC2)CCO1.
What is the InChIKey of 2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone?
The InChIKey is ZCXJTWIYFOIDHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O3/c1-18-8-2-12-10-15(7-9-19-12)11-13(17)16-5-3-14-4-6-16/h12,14H,2-11H2,1H3.
What are the key properties of 2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone?
2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone has a molecular weight of 271.36 g/mol, XLogP of -0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyethyl)morpholin-4-yl]-1-piperazin-1-ylethanone is sourced from PubChem (CID 131914885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).