ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate

C11H22N2O2 — CID 143591988

IUPACethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(N(C)CC)CC1
InChIInChI=1S/C11H22N2O2/c1-4-12(3)10-6-8-13(9-7-10)11(14)15-5-2/h10H,4-9H2,1-3H3
InChIKeyCQIZDNVFJQDTRJ-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.56
Rot. Bonds3

About ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate

ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate (PubChem CID 143591988) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate.

Molecular Properties

Compound Nameethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate
PubChem CID143591988
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Nameethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(N(C)CC)CC1
InChIInChI=1S/C11H22N2O2/c1-4-12(3)10-6-8-13(9-7-10)11(14)15-5-2/h10H,4-9H2,1-3H3
InChIKeyCQIZDNVFJQDTRJ-UHFFFAOYSA-N
XLogP1.56
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate?
The IUPAC name of ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate (CID 143591988) is ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate.
What is the SMILES notation for ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate?
The canonical SMILES for ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate is CCOC(=O)N1CCC(N(C)CC)CC1.
What is the InChIKey of ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate?
The InChIKey is CQIZDNVFJQDTRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-4-12(3)10-6-8-13(9-7-10)11(14)15-5-2/h10H,4-9H2,1-3H3.
What are the key properties of ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate?
ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate has a molecular weight of 214.31 g/mol, XLogP of 1.56, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-[ethyl(methyl)amino]piperidine-1-carboxylate is sourced from PubChem (CID 143591988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).