1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one

C11H22N2O2 — CID 112704602

IUPAC1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one
SMILESCCN1CCN(C(=O)C(C)OC)CC1C
InChIInChI=1S/C11H22N2O2/c1-5-12-6-7-13(8-9(12)2)11(14)10(3)15-4/h9-10H,5-8H2,1-4H3
InChIKeyFMVOXNMVJSZVRK-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.57
Rot. Bonds3

About 1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one

1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one (PubChem CID 112704602) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one.

Molecular Properties

Compound Name1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one
PubChem CID112704602
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one
SMILESCCN1CCN(C(=O)C(C)OC)CC1C
InChIInChI=1S/C11H22N2O2/c1-5-12-6-7-13(8-9(12)2)11(14)10(3)15-4/h9-10H,5-8H2,1-4H3
InChIKeyFMVOXNMVJSZVRK-UHFFFAOYSA-N
XLogP0.57
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-(4-ethyl-3-methylpiperazin-1-yl)propan-1-one
CID 63633519
1-(4-ethyl-3-methylpiperazin-1-yl)-2-methyl-3-(methylamino)propan-1-one
CID 79202672
3-(4-ethyl-3-methylpiperazin-1-yl)-2-methyl-3-oxopropanenitrile
CID 55216609
1-(4-ethyl-3-methylpiperazin-1-yl)-2-piperazin-1-ylpropan-1-one
CID 63620232
3-[(4-ethyl-3-methylpiperazine-1-carbonyl)amino]-2-methoxypropanoic acid
CID 106110182
2-(4-ethyl-3-methylpiperazine-1-carbonyl)butanethioamide
CID 55215265
4-[(4-ethyl-3-methylpiperazine-1-carbonyl)amino]-3-methoxybutanoic acid
CID 103159409
2-ethoxy-1-(4-ethyl-3-methylpiperazin-1-yl)ethanone
CID 64590973
1-(3-ethylpyrrolidin-1-yl)-2-methoxypropan-1-one
CID 115686899
2-(tert-butylamino)-1-(4-ethyl-3-methylpiperazin-1-yl)ethanone
CID 79256800
2-[(4-ethyl-3-methylpiperazine-1-carbonyl)-methylamino]propanoic acid
CID 63614715
4-[(4-ethyl-3-methylpiperazine-1-carbonyl)amino]-2-methylbutanoic acid
CID 80540967

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one?
The IUPAC name of 1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one (CID 112704602) is 1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one.
What is the SMILES notation for 1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one?
The canonical SMILES for 1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one is CCN1CCN(C(=O)C(C)OC)CC1C.
What is the InChIKey of 1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one?
The InChIKey is FMVOXNMVJSZVRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-5-12-6-7-13(8-9(12)2)11(14)10(3)15-4/h9-10H,5-8H2,1-4H3.
What are the key properties of 1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one?
1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one has a molecular weight of 214.31 g/mol, XLogP of 0.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethyl-3-methylpiperazin-1-yl)-2-methoxypropan-1-one is sourced from PubChem (CID 112704602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).