2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one

C11H22N2O2 — CID 60683953

IUPAC2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one
SMILESCC(C(=O)N1CCCCC1)N(C)CCO
InChIInChI=1S/C11H22N2O2/c1-10(12(2)8-9-14)11(15)13-6-4-3-5-7-13/h10,14H,3-9H2,1-2H3
InChIKeyLOOLWJSWALZAJX-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.31
Rot. Bonds4

About 2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one

2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one (PubChem CID 60683953) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one.

Molecular Properties

Compound Name2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one
PubChem CID60683953
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one
SMILESCC(C(=O)N1CCCCC1)N(C)CCO
InChIInChI=1S/C11H22N2O2/c1-10(12(2)8-9-14)11(15)13-6-4-3-5-7-13/h10,14H,3-9H2,1-2H3
InChIKeyLOOLWJSWALZAJX-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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Related Compounds

4-[[1-(azepan-1-yl)-1-oxopropan-2-yl]-methylamino]butanoic acid
CID 55005650
N,N-dimethyl-2-[methyl-(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]acetamide
CID 78809290
2-[(3-amino-4-methylpentyl)-methylamino]-1-pyrrolidin-1-ylpropan-1-one
CID 81491160
N-(2-hydroxyethyl)-N-methylpiperidine-1-carboxamide
CID 68606002
2-[benzyl(methyl)amino]-1-piperidin-1-ylpropan-1-one
CID 78786454
2-[bis(2-chloroethyl)amino]-1-piperidin-1-ylpropan-1-one
CID 3064207
2-[(1-hydroxy-2-methylpropan-2-yl)-methylamino]-1-piperidin-1-ylpropan-1-one
CID 113476280
2-[methyl-(2-oxo-2-piperazin-1-ylethyl)amino]-1-piperidin-1-ylpropan-1-one
CID 61018825
2-[methyl-[(4-methylphenyl)methyl]amino]-1-piperidin-1-ylpropan-1-one
CID 78786460
2-[1-adamantylmethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one
CID 112799397
2-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)amino]-1-piperazin-1-ylpropan-1-one
CID 61441971
2-[methyl(propyl)amino]-1-piperazin-1-ylpropan-1-one
CID 43271283

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one?
The IUPAC name of 2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one (CID 60683953) is 2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one.
What is the SMILES notation for 2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one?
The canonical SMILES for 2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one is CC(C(=O)N1CCCCC1)N(C)CCO.
What is the InChIKey of 2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one?
The InChIKey is LOOLWJSWALZAJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-10(12(2)8-9-14)11(15)13-6-4-3-5-7-13/h10,14H,3-9H2,1-2H3.
What are the key properties of 2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one?
2-[2-hydroxyethyl(methyl)amino]-1-piperidin-1-ylpropan-1-one 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-piperidin-1-ylpropan-1-one is sourced from PubChem (CID 60683953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).