ethyl 2-[ethyl(piperidin-4-yl)amino]acetate

C11H22N2O2 — CID 60805794

IUPACethyl 2-[ethyl(piperidin-4-yl)amino]acetate
SMILESCCOC(=O)CN(CC)C1CCNCC1
InChIInChI=1S/C11H22N2O2/c1-3-13(9-11(14)15-4-2)10-5-7-12-8-6-10/h10,12H,3-9H2,1-2H3
InChIKeyWUCIGITZPKKCHJ-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.62
Rot. Bonds5

About ethyl 2-[ethyl(piperidin-4-yl)amino]acetate

ethyl 2-[ethyl(piperidin-4-yl)amino]acetate (PubChem CID 60805794) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is ethyl 2-[ethyl(piperidin-4-yl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[ethyl(piperidin-4-yl)amino]acetate
PubChem CID60805794
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Nameethyl 2-[ethyl(piperidin-4-yl)amino]acetate
SMILESCCOC(=O)CN(CC)C1CCNCC1
InChIInChI=1S/C11H22N2O2/c1-3-13(9-11(14)15-4-2)10-5-7-12-8-6-10/h10,12H,3-9H2,1-2H3
InChIKeyWUCIGITZPKKCHJ-UHFFFAOYSA-N
XLogP0.62
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[ethyl(piperidin-4-yl)amino]acetate?
The IUPAC name of ethyl 2-[ethyl(piperidin-4-yl)amino]acetate (CID 60805794) is ethyl 2-[ethyl(piperidin-4-yl)amino]acetate.
What is the SMILES notation for ethyl 2-[ethyl(piperidin-4-yl)amino]acetate?
The canonical SMILES for ethyl 2-[ethyl(piperidin-4-yl)amino]acetate is CCOC(=O)CN(CC)C1CCNCC1.
What is the InChIKey of ethyl 2-[ethyl(piperidin-4-yl)amino]acetate?
The InChIKey is WUCIGITZPKKCHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-13(9-11(14)15-4-2)10-5-7-12-8-6-10/h10,12H,3-9H2,1-2H3.
What are the key properties of ethyl 2-[ethyl(piperidin-4-yl)amino]acetate?
ethyl 2-[ethyl(piperidin-4-yl)amino]acetate has a molecular weight of 214.31 g/mol, XLogP of 0.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[ethyl(piperidin-4-yl)amino]acetate is sourced from PubChem (CID 60805794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).