2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate

C12H24N2O3 — CID 86789186

IUPAC2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate
SMILESCCOC1CCCN(CCOC(=O)N(C)C)C1
InChIInChI=1S/C12H24N2O3/c1-4-16-11-6-5-7-14(10-11)8-9-17-12(15)13(2)3/h11H,4-10H2,1-3H3
InChIKeyAEIYACVPVXLORB-UHFFFAOYSA-N
MW244.33 g/mol
LogP1.19
Rot. Bonds5

About 2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate

2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate (PubChem CID 86789186) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is 2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate.

Molecular Properties

Compound Name2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate
PubChem CID86789186
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC Name2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate
SMILESCCOC1CCCN(CCOC(=O)N(C)C)C1
InChIInChI=1S/C12H24N2O3/c1-4-16-11-6-5-7-14(10-11)8-9-17-12(15)13(2)3/h11H,4-10H2,1-3H3
InChIKeyAEIYACVPVXLORB-UHFFFAOYSA-N
XLogP1.19
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate?
The IUPAC name of 2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate (CID 86789186) is 2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate.
What is the SMILES notation for 2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate?
The canonical SMILES for 2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate is CCOC1CCCN(CCOC(=O)N(C)C)C1.
What is the InChIKey of 2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate?
The InChIKey is AEIYACVPVXLORB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-4-16-11-6-5-7-14(10-11)8-9-17-12(15)13(2)3/h11H,4-10H2,1-3H3.
What are the key properties of 2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate?
2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate has a molecular weight of 244.33 g/mol, XLogP of 1.19, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxypiperidin-1-yl)ethyl N,N-dimethylcarbamate is sourced from PubChem (CID 86789186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).