ethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate

C11H22N2O2 — CID 126549519

IUPACethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate
SMILESCCOC(=O)N(CC)C1CCN(C)CC1
InChIInChI=1S/C11H22N2O2/c1-4-13(11(14)15-5-2)10-6-8-12(3)9-7-10/h10H,4-9H2,1-3H3
InChIKeySAXIMEAPAOPXHV-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.56
Rot. Bonds3

About ethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate

ethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate (PubChem CID 126549519) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is ethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate.

Molecular Properties

Compound Nameethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate
PubChem CID126549519
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Nameethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate
SMILESCCOC(=O)N(CC)C1CCN(C)CC1
InChIInChI=1S/C11H22N2O2/c1-4-13(11(14)15-5-2)10-6-8-12(3)9-7-10/h10H,4-9H2,1-3H3
InChIKeySAXIMEAPAOPXHV-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 N-ethyl-N-(1-methylpiperidin-4-yl)carbamate?
The IUPAC name of ethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate (CID 126549519) is ethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate.
What is the SMILES notation for ethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate?
The canonical SMILES for ethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate is CCOC(=O)N(CC)C1CCN(C)CC1.
What is the InChIKey of ethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate?
The InChIKey is SAXIMEAPAOPXHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-4-13(11(14)15-5-2)10-6-8-12(3)9-7-10/h10H,4-9H2,1-3H3.
What are the key properties of ethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate?
ethyl N-ethyl-N-(1-methylpiperidin-4-yl)carbamate 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 N-ethyl-N-(1-methylpiperidin-4-yl)carbamate is sourced from PubChem (CID 126549519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).