ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate

C14H26N2O3 — CID 60686884

IUPACethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate
SMILESCCOC(=O)C1CCCN(CCN2CCOCC2)C1
InChIInChI=1S/C14H26N2O3/c1-2-19-14(17)13-4-3-5-16(12-13)7-6-15-8-10-18-11-9-15/h13H,2-12H2,1H3
InChIKeyMEAUNMBVBZTRBJ-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.59
Rot. Bonds5

About ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate

ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate (PubChem CID 60686884) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate.

Molecular Properties

Compound Nameethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate
PubChem CID60686884
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Nameethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate
SMILESCCOC(=O)C1CCCN(CCN2CCOCC2)C1
InChIInChI=1S/C14H26N2O3/c1-2-19-14(17)13-4-3-5-16(12-13)7-6-15-8-10-18-11-9-15/h13H,2-12H2,1H3
InChIKeyMEAUNMBVBZTRBJ-UHFFFAOYSA-N
XLogP0.59
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate?
The IUPAC name of ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate (CID 60686884) is ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate.
What is the SMILES notation for ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate?
The canonical SMILES for ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate is CCOC(=O)C1CCCN(CCN2CCOCC2)C1.
What is the InChIKey of ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate?
The InChIKey is MEAUNMBVBZTRBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-2-19-14(17)13-4-3-5-16(12-13)7-6-15-8-10-18-11-9-15/h13H,2-12H2,1H3.
What are the key properties of ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate?
ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate has a molecular weight of 270.37 g/mol, XLogP of 0.59, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 1-(2-morpholin-4-ylethyl)piperidine-3-carboxylate is sourced from PubChem (CID 60686884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).