ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate

C11H22N2O2 — CID 83990671

IUPACethyl 2-[3-(ethylamino)piperidin-1-yl]acetate
SMILESCCNC1CCCN(CC(=O)OCC)C1
InChIInChI=1S/C11H22N2O2/c1-3-12-10-6-5-7-13(8-10)9-11(14)15-4-2/h10,12H,3-9H2,1-2H3
InChIKeyFIDMUKCWMGEBHV-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.62
Rot. Bonds5

About ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate

ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate (PubChem CID 83990671) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[3-(ethylamino)piperidin-1-yl]acetate
PubChem CID83990671
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Nameethyl 2-[3-(ethylamino)piperidin-1-yl]acetate
SMILESCCNC1CCCN(CC(=O)OCC)C1
InChIInChI=1S/C11H22N2O2/c1-3-12-10-6-5-7-13(8-10)9-11(14)15-4-2/h10,12H,3-9H2,1-2H3
InChIKeyFIDMUKCWMGEBHV-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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Related Compounds

methyl 1-(2-ethoxy-2-oxoethyl)piperidine-3-carboxylate
CID 53421319
1-(2-ethoxy-2-oxoethyl)piperidine-3-carboxylic acid
CID 170458411
ethyl 2-(3-tert-butylpiperidin-1-yl)acetate
CID 176945818
ethyl 2-[3-(2-hydroxyethyl)piperidin-1-yl]acetate
CID 62356988
methyl 2-[3-(cyclopentylmethylamino)piperidin-1-yl]acetate
CID 83998161
ethyl 2-(azocan-1-yl)acetate
CID 25219274
tert-butyl 2-[3-(cyclopropylmethylamino)piperidin-1-yl]acetate
CID 83996792
ethyl 2-(3-ethylpyrrolidin-1-yl)acetate
CID 115688617
methyl 2-[3-(cyclohexylamino)piperidin-1-yl]acetate
CID 83999544
1-(2-ethoxy-2-methylpropyl)-N-ethylpiperidin-3-amine
CID 114944306
ethyl 4-[3-(hydroxymethyl)piperidin-1-yl]-3-oxobutanoate
CID 63898307
tert-butyl 2-[3-(cyclopentylmethylamino)piperidin-1-yl]acetate
CID 83998176

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate?
The IUPAC name of ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate (CID 83990671) is ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate.
What is the SMILES notation for ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate?
The canonical SMILES for ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate is CCNC1CCCN(CC(=O)OCC)C1.
What is the InChIKey of ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate?
The InChIKey is FIDMUKCWMGEBHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-12-10-6-5-7-13(8-10)9-11(14)15-4-2/h10,12H,3-9H2,1-2H3.
What are the key properties of ethyl 2-[3-(ethylamino)piperidin-1-yl]acetate?
ethyl 2-[3-(ethylamino)piperidin-1-yl]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-[3-(ethylamino)piperidin-1-yl]acetate is sourced from PubChem (CID 83990671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).