(1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate

C12H24N2O2 — CID 175337294

IUPAC(1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate
SMILESCCNC(=O)OC1CCN(C)C(C)(C)C1C
InChIInChI=1S/C12H24N2O2/c1-6-13-11(15)16-10-7-8-14(5)12(3,4)9(10)2/h9-10H,6-8H2,1-5H3,(H,13,15)
InChIKeyFVABXRLUNNTGHO-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.85
Rot. Bonds2

About (1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate

(1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate (PubChem CID 175337294) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is (1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate.

Molecular Properties

Compound Name(1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate
PubChem CID175337294
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name(1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate
SMILESCCNC(=O)OC1CCN(C)C(C)(C)C1C
InChIInChI=1S/C12H24N2O2/c1-6-13-11(15)16-10-7-8-14(5)12(3,4)9(10)2/h9-10H,6-8H2,1-5H3,(H,13,15)
InChIKeyFVABXRLUNNTGHO-UHFFFAOYSA-N
XLogP1.85
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate?
The IUPAC name of (1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate (CID 175337294) is (1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate.
What is the SMILES notation for (1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate?
The canonical SMILES for (1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate is CCNC(=O)OC1CCN(C)C(C)(C)C1C.
What is the InChIKey of (1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate?
The InChIKey is FVABXRLUNNTGHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-6-13-11(15)16-10-7-8-14(5)12(3,4)9(10)2/h9-10H,6-8H2,1-5H3,(H,13,15).
What are the key properties of (1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate?
(1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate has a molecular weight of 228.34 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2,2,3-tetramethylpiperidin-4-yl) N-ethylcarbamate is sourced from PubChem (CID 175337294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).