1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone

C11H22N2O2 — CID 53150919

IUPAC1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone
SMILESCNCC(=O)N1CCC(CCOC)CC1
InChIInChI=1S/C11H22N2O2/c1-12-9-11(14)13-6-3-10(4-7-13)5-8-15-2/h10,12H,3-9H2,1-2H3
InChIKeyXDOPVBNMAUIUEX-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.48
Rot. Bonds5

About 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone

1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone (PubChem CID 53150919) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone.

Molecular Properties

Compound Name1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone
PubChem CID53150919
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone
SMILESCNCC(=O)N1CCC(CCOC)CC1
InChIInChI=1S/C11H22N2O2/c1-12-9-11(14)13-6-3-10(4-7-13)5-8-15-2/h10,12H,3-9H2,1-2H3
InChIKeyXDOPVBNMAUIUEX-UHFFFAOYSA-N
XLogP0.48
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone?
The IUPAC name of 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone (CID 53150919) is 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone.
What is the SMILES notation for 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone?
The canonical SMILES for 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone is CNCC(=O)N1CCC(CCOC)CC1.
What is the InChIKey of 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone?
The InChIKey is XDOPVBNMAUIUEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-12-9-11(14)13-6-3-10(4-7-13)5-8-15-2/h10,12H,3-9H2,1-2H3.
What are the key properties of 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone?
1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone has a molecular weight of 214.31 g/mol, XLogP of 0.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methoxyethyl)piperidin-1-yl]-2-(methylamino)ethanone is sourced from PubChem (CID 53150919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).