ethyl N-piperidin-2-ylcarbamate

C8H16N2O2 — CID 54283157

IUPACethyl N-piperidin-2-ylcarbamate
SMILESCCOC(=O)NC1CCCCN1
InChIInChI=1S/C8H16N2O2/c1-2-12-8(11)10-7-5-3-4-6-9-7/h7,9H,2-6H2,1H3,(H,10,11)
InChIKeyNJLOSAPEAMUTBQ-UHFFFAOYSA-N
MW172.23 g/mol
LogP0.83
Rot. Bonds2

About ethyl N-piperidin-2-ylcarbamate

ethyl N-piperidin-2-ylcarbamate (PubChem CID 54283157) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is ethyl N-piperidin-2-ylcarbamate.

Molecular Properties

Compound Nameethyl N-piperidin-2-ylcarbamate
PubChem CID54283157
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Nameethyl N-piperidin-2-ylcarbamate
SMILESCCOC(=O)NC1CCCCN1
InChIInChI=1S/C8H16N2O2/c1-2-12-8(11)10-7-5-3-4-6-9-7/h7,9H,2-6H2,1H3,(H,10,11)
InChIKeyNJLOSAPEAMUTBQ-UHFFFAOYSA-N
XLogP0.83
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethyl N-piperidin-2-ylcarbamate?
The IUPAC name of ethyl N-piperidin-2-ylcarbamate (CID 54283157) is ethyl N-piperidin-2-ylcarbamate.
What is the SMILES notation for ethyl N-piperidin-2-ylcarbamate?
The canonical SMILES for ethyl N-piperidin-2-ylcarbamate is CCOC(=O)NC1CCCCN1.
What is the InChIKey of ethyl N-piperidin-2-ylcarbamate?
The InChIKey is NJLOSAPEAMUTBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-2-12-8(11)10-7-5-3-4-6-9-7/h7,9H,2-6H2,1H3,(H,10,11).
What are the key properties of ethyl N-piperidin-2-ylcarbamate?
ethyl N-piperidin-2-ylcarbamate has a molecular weight of 172.23 g/mol, XLogP of 0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-piperidin-2-ylcarbamate is sourced from PubChem (CID 54283157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).