(1-methylpiperidin-4-yl) N-methylcarbamate

C8H16N2O2 — CID 15229087

IUPAC(1-methylpiperidin-4-yl) N-methylcarbamate
SMILESCNC(=O)OC1CCN(C)CC1
InChIInChI=1S/C8H16N2O2/c1-9-8(11)12-7-3-5-10(2)6-4-7/h7H,3-6H2,1-2H3,(H,9,11)
InChIKeyGGEZCLGZQVGHLJ-UHFFFAOYSA-N
MW172.23 g/mol
LogP0.44
Rot. Bonds1

About (1-methylpiperidin-4-yl) N-methylcarbamate

(1-methylpiperidin-4-yl) N-methylcarbamate (PubChem CID 15229087) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is (1-methylpiperidin-4-yl) N-methylcarbamate.

Molecular Properties

Compound Name(1-methylpiperidin-4-yl) N-methylcarbamate
PubChem CID15229087
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name(1-methylpiperidin-4-yl) N-methylcarbamate
SMILESCNC(=O)OC1CCN(C)CC1
InChIInChI=1S/C8H16N2O2/c1-9-8(11)12-7-3-5-10(2)6-4-7/h7H,3-6H2,1-2H3,(H,9,11)
InChIKeyGGEZCLGZQVGHLJ-UHFFFAOYSA-N
XLogP0.44
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-methylpiperidin-4-yl) N-methylcarbamate?
The IUPAC name of (1-methylpiperidin-4-yl) N-methylcarbamate (CID 15229087) is (1-methylpiperidin-4-yl) N-methylcarbamate.
What is the SMILES notation for (1-methylpiperidin-4-yl) N-methylcarbamate?
The canonical SMILES for (1-methylpiperidin-4-yl) N-methylcarbamate is CNC(=O)OC1CCN(C)CC1.
What is the InChIKey of (1-methylpiperidin-4-yl) N-methylcarbamate?
The InChIKey is GGEZCLGZQVGHLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-9-8(11)12-7-3-5-10(2)6-4-7/h7H,3-6H2,1-2H3,(H,9,11).
What are the key properties of (1-methylpiperidin-4-yl) N-methylcarbamate?
(1-methylpiperidin-4-yl) N-methylcarbamate has a molecular weight of 172.23 g/mol, XLogP of 0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpiperidin-4-yl) N-methylcarbamate is sourced from PubChem (CID 15229087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).