1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one

C11H21NO2 — CID 140969049

IUPAC1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one
SMILESCCC(=O)C1CCN(CCOC)CC1
InChIInChI=1S/C11H21NO2/c1-3-11(13)10-4-6-12(7-5-10)8-9-14-2/h10H,3-9H2,1-2H3
InChIKeyCPKPXSYBYHNYFX-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.32
Rot. Bonds5

About 1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one

1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one (PubChem CID 140969049) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one.

Molecular Properties

Compound Name1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one
PubChem CID140969049
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one
SMILESCCC(=O)C1CCN(CCOC)CC1
InChIInChI=1S/C11H21NO2/c1-3-11(13)10-4-6-12(7-5-10)8-9-14-2/h10H,3-9H2,1-2H3
InChIKeyCPKPXSYBYHNYFX-UHFFFAOYSA-N
XLogP1.32
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-Piperidinone, 1-(2-ethoxyethyl)-3-methyl-, hydrochloride (1:1)
CID 3066145
1-(2-Methoxyethyl)piperidine-4-carbaldehyde
CID 17893954
Methyl 2-(4-acetylpiperidin-1-yl)acetate
CID 57941101
6-((2-Methoxyethyl)(methyl)amino)-2-methylhexan-3-one
CID 156498079
1-(2-Ethoxyethyl)-3-methylpiperidin-4-one
CID 3066146
Cyclopentanone, 2-(4-morpholinylmethyl)-
CID 382864
4-Methyl-5-morpholino-pentane-2-one
CID 129771205
2-(Morpholinomethyl)-4-oxopentanenitrile
CID 168654931
2-(Morpholinomethyl)-4-oxohexanenitrile
CID 168654944
1-[1-[2-(2,2,2-Trifluoroethoxy)ethyl]piperidin-4-yl]ethanone
CID 63846875
1-[1-[2-(Trifluoromethoxy)ethyl]piperidin-3-yl]ethanone
CID 65803453
1-[1-[2-(Trifluoromethoxy)ethyl]piperidin-4-yl]ethanone
CID 65803661

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one?
The IUPAC name of 1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one (CID 140969049) is 1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one.
What is the SMILES notation for 1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one?
The canonical SMILES for 1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one is CCC(=O)C1CCN(CCOC)CC1.
What is the InChIKey of 1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one?
The InChIKey is CPKPXSYBYHNYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-11(13)10-4-6-12(7-5-10)8-9-14-2/h10H,3-9H2,1-2H3.
What are the key properties of 1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one?
1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one has a molecular weight of 199.29 g/mol, XLogP of 1.32, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxyethyl)piperidin-4-yl]propan-1-one is sourced from PubChem (CID 140969049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).