ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate

C11H21NO3 — CID 56753969

IUPACethyl 4-(2-methoxyethyl)piperidine-4-carboxylate
SMILESCCOC(=O)C1(CCOC)CCNCC1
InChIInChI=1S/C11H21NO3/c1-3-15-10(13)11(6-9-14-2)4-7-12-8-5-11/h12H,3-9H2,1-2H3
InChIKeyPLMXEKYDGVPURB-UHFFFAOYSA-N
MW215.29 g/mol
LogP0.96
Rot. Bonds5

About ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate

ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate (PubChem CID 56753969) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate.

Molecular Properties

Compound Nameethyl 4-(2-methoxyethyl)piperidine-4-carboxylate
PubChem CID56753969
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Nameethyl 4-(2-methoxyethyl)piperidine-4-carboxylate
SMILESCCOC(=O)C1(CCOC)CCNCC1
InChIInChI=1S/C11H21NO3/c1-3-15-10(13)11(6-9-14-2)4-7-12-8-5-11/h12H,3-9H2,1-2H3
InChIKeyPLMXEKYDGVPURB-UHFFFAOYSA-N
XLogP0.96
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate?
The IUPAC name of ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate (CID 56753969) is ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate.
What is the SMILES notation for ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate?
The canonical SMILES for ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate is CCOC(=O)C1(CCOC)CCNCC1.
What is the InChIKey of ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate?
The InChIKey is PLMXEKYDGVPURB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-3-15-10(13)11(6-9-14-2)4-7-12-8-5-11/h12H,3-9H2,1-2H3.
What are the key properties of ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate?
ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate has a molecular weight of 215.29 g/mol, XLogP of 0.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-(2-methoxyethyl)piperidine-4-carboxylate is sourced from PubChem (CID 56753969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).