piperidin-2-ylmethyl N,N-diethylcarbamate

C11H22N2O2 — CID 79337407

IUPACpiperidin-2-ylmethyl N,N-diethylcarbamate
SMILESCCN(CC)C(=O)OCC1CCCCN1
InChIInChI=1S/C11H22N2O2/c1-3-13(4-2)11(14)15-9-10-7-5-6-8-12-10/h10,12H,3-9H2,1-2H3
InChIKeyMAXSIEUAVJCGCR-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.61
Rot. Bonds4

About piperidin-2-ylmethyl N,N-diethylcarbamate

piperidin-2-ylmethyl N,N-diethylcarbamate (PubChem CID 79337407) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is piperidin-2-ylmethyl N,N-diethylcarbamate.

Molecular Properties

Compound Namepiperidin-2-ylmethyl N,N-diethylcarbamate
PubChem CID79337407
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Namepiperidin-2-ylmethyl N,N-diethylcarbamate
SMILESCCN(CC)C(=O)OCC1CCCCN1
InChIInChI=1S/C11H22N2O2/c1-3-13(4-2)11(14)15-9-10-7-5-6-8-12-10/h10,12H,3-9H2,1-2H3
InChIKeyMAXSIEUAVJCGCR-UHFFFAOYSA-N
XLogP1.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze piperidin-2-ylmethyl N,N-diethylcarbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of piperidin-2-ylmethyl N,N-diethylcarbamate?
The IUPAC name of piperidin-2-ylmethyl N,N-diethylcarbamate (CID 79337407) is piperidin-2-ylmethyl N,N-diethylcarbamate.
What is the SMILES notation for piperidin-2-ylmethyl N,N-diethylcarbamate?
The canonical SMILES for piperidin-2-ylmethyl N,N-diethylcarbamate is CCN(CC)C(=O)OCC1CCCCN1.
What is the InChIKey of piperidin-2-ylmethyl N,N-diethylcarbamate?
The InChIKey is MAXSIEUAVJCGCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-13(4-2)11(14)15-9-10-7-5-6-8-12-10/h10,12H,3-9H2,1-2H3.
What are the key properties of piperidin-2-ylmethyl N,N-diethylcarbamate?
piperidin-2-ylmethyl N,N-diethylcarbamate has a molecular weight of 214.31 g/mol, XLogP of 1.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-2-ylmethyl N,N-diethylcarbamate is sourced from PubChem (CID 79337407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).