2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone

C11H22N2O2 — CID 60683912

IUPAC2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone
SMILESCC1CCCCN1C(=O)CN(C)CCO
InChIInChI=1S/C11H22N2O2/c1-10-5-3-4-6-13(10)11(15)9-12(2)7-8-14/h10,14H,3-9H2,1-2H3
InChIKeyJQJIIBHFXPOPPB-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.31
Rot. Bonds4

About 2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone

2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone (PubChem CID 60683912) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone
PubChem CID60683912
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone
SMILESCC1CCCCN1C(=O)CN(C)CCO
InChIInChI=1S/C11H22N2O2/c1-10-5-3-4-6-13(10)11(15)9-12(2)7-8-14/h10,14H,3-9H2,1-2H3
InChIKeyJQJIIBHFXPOPPB-UHFFFAOYSA-N
XLogP0.31
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone?
The IUPAC name of 2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone (CID 60683912) is 2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone is CC1CCCCN1C(=O)CN(C)CCO.
What is the InChIKey of 2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone?
The InChIKey is JQJIIBHFXPOPPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-10-5-3-4-6-13(10)11(15)9-12(2)7-8-14/h10,14H,3-9H2,1-2H3.
What are the key properties of 2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone?
2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone has a molecular weight of 214.31 g/mol, XLogP of 0.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(methyl)amino]-1-(2-methylpiperidin-1-yl)ethanone is sourced from PubChem (CID 60683912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).