tert-butyl N-methyl-N-piperidin-4-ylcarbamate

C11H22N2O2 — CID 2756806

IUPACtert-butyl N-methyl-N-piperidin-4-ylcarbamate
SMILESCN(C(=O)OC(C)(C)C)C1CCNCC1
InChIInChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13(4)9-5-7-12-8-6-9/h9,12H,5-8H2,1-4H3
InChIKeyDJJOYDXRUBOZON-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.61
Rot. Bonds1

About tert-butyl N-methyl-N-piperidin-4-ylcarbamate

tert-butyl N-methyl-N-piperidin-4-ylcarbamate (PubChem CID 2756806) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is tert-butyl N-methyl-N-piperidin-4-ylcarbamate.

Molecular Properties

Compound Nametert-butyl N-methyl-N-piperidin-4-ylcarbamate
PubChem CID2756806
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Nametert-butyl N-methyl-N-piperidin-4-ylcarbamate
SMILESCN(C(=O)OC(C)(C)C)C1CCNCC1
InChIInChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13(4)9-5-7-12-8-6-9/h9,12H,5-8H2,1-4H3
InChIKeyDJJOYDXRUBOZON-UHFFFAOYSA-N
XLogP1.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
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 tert-butyl N-methyl-N-piperidin-4-ylcarbamate 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 tert-butyl N-methyl-N-piperidin-4-ylcarbamate?
The IUPAC name of tert-butyl N-methyl-N-piperidin-4-ylcarbamate (CID 2756806) is tert-butyl N-methyl-N-piperidin-4-ylcarbamate.
What is the SMILES notation for tert-butyl N-methyl-N-piperidin-4-ylcarbamate?
The canonical SMILES for tert-butyl N-methyl-N-piperidin-4-ylcarbamate is CN(C(=O)OC(C)(C)C)C1CCNCC1.
What is the InChIKey of tert-butyl N-methyl-N-piperidin-4-ylcarbamate?
The InChIKey is DJJOYDXRUBOZON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13(4)9-5-7-12-8-6-9/h9,12H,5-8H2,1-4H3.
What are the key properties of tert-butyl N-methyl-N-piperidin-4-ylcarbamate?
tert-butyl N-methyl-N-piperidin-4-ylcarbamate has a molecular weight of 214.31 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-methyl-N-piperidin-4-ylcarbamate is sourced from PubChem (CID 2756806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).