ethyl 2-piperidin-2-yloxyacetate

C9H17NO3 — CID 68921876

IUPACethyl 2-piperidin-2-yloxyacetate
SMILESCCOC(=O)COC1CCCCN1
InChIInChI=1S/C9H17NO3/c1-2-12-9(11)7-13-8-5-3-4-6-10-8/h8,10H,2-7H2,1H3
InChIKeyCZGNQUYADXEZQF-UHFFFAOYSA-N
MW187.24 g/mol
LogP0.67
Rot. Bonds4

About ethyl 2-piperidin-2-yloxyacetate

ethyl 2-piperidin-2-yloxyacetate (PubChem CID 68921876) has the molecular formula C9H17NO3 and a molecular weight of 187.24 g/mol. Its IUPAC name is ethyl 2-piperidin-2-yloxyacetate.

Molecular Properties

Compound Nameethyl 2-piperidin-2-yloxyacetate
PubChem CID68921876
Molecular FormulaC9H17NO3
Molecular Weight187.24 g/mol
Exact Mass187.12
IUPAC Nameethyl 2-piperidin-2-yloxyacetate
SMILESCCOC(=O)COC1CCCCN1
InChIInChI=1S/C9H17NO3/c1-2-12-9(11)7-13-8-5-3-4-6-10-8/h8,10H,2-7H2,1H3
InChIKeyCZGNQUYADXEZQF-UHFFFAOYSA-N
XLogP0.67
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxyazepane
CID 133058336
ethyl 2-(pyrrolidin-2-ylmethoxy)acetate
CID 106939447
ethyl 2-(2-ethylcyclohexyl)oxyacetate
CID 43119660
ethyl 3-piperidin-2-ylpentanoate
CID 67315004
ethyl 3-(2-piperidin-2-ylethylsulfanyl)propanoate
CID 134086079
ethyl 2-(2,2-difluoro-3-piperidin-2-ylcyclopropyl)acetate;hydrochloride
CID 126845612
piperidin-2-yl octadecanoate
CID 54524837
butyl piperidin-2-yl carbonate
CID 54057815
[(2R)-pyrrolidin-2-yl] butanoate
CID 45090959
[(2S)-pyrrolidin-2-yl] butanoate
CID 45090958
ethyl 4-[[(2S)-piperidine-2-carbonyl]amino]butanoate
CID 103809125
ethyl (2E)-N-hydroxypyrrolidine-2-carboximidate
CID 101141601

Frequently Asked Questions

What is the IUPAC name of ethyl 2-piperidin-2-yloxyacetate?
The IUPAC name of ethyl 2-piperidin-2-yloxyacetate (CID 68921876) is ethyl 2-piperidin-2-yloxyacetate.
What is the SMILES notation for ethyl 2-piperidin-2-yloxyacetate?
The canonical SMILES for ethyl 2-piperidin-2-yloxyacetate is CCOC(=O)COC1CCCCN1.
What is the InChIKey of ethyl 2-piperidin-2-yloxyacetate?
The InChIKey is CZGNQUYADXEZQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO3/c1-2-12-9(11)7-13-8-5-3-4-6-10-8/h8,10H,2-7H2,1H3.
What are the key properties of ethyl 2-piperidin-2-yloxyacetate?
ethyl 2-piperidin-2-yloxyacetate has a molecular weight of 187.24 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-piperidin-2-yloxyacetate is sourced from PubChem (CID 68921876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).