piperidin-1-yl N-piperidin-1-ylcarbamate

C11H21N3O2 — CID 57271004

IUPACpiperidin-1-yl N-piperidin-1-ylcarbamate
SMILESO=C(NN1CCCCC1)ON1CCCCC1
InChIInChI=1S/C11H21N3O2/c15-11(12-13-7-3-1-4-8-13)16-14-9-5-2-6-10-14/h1-10H2,(H,12,15)
InChIKeyATAQBXLQOALOFQ-UHFFFAOYSA-N
MW227.31 g/mol
LogP1.51
Rot. Bonds2

About piperidin-1-yl N-piperidin-1-ylcarbamate

piperidin-1-yl N-piperidin-1-ylcarbamate (PubChem CID 57271004) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is piperidin-1-yl N-piperidin-1-ylcarbamate.

Molecular Properties

Compound Namepiperidin-1-yl N-piperidin-1-ylcarbamate
PubChem CID57271004
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Namepiperidin-1-yl N-piperidin-1-ylcarbamate
SMILESO=C(NN1CCCCC1)ON1CCCCC1
InChIInChI=1S/C11H21N3O2/c15-11(12-13-7-3-1-4-8-13)16-14-9-5-2-6-10-14/h1-10H2,(H,12,15)
InChIKeyATAQBXLQOALOFQ-UHFFFAOYSA-N
XLogP1.51
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of piperidin-1-yl N-piperidin-1-ylcarbamate?
The IUPAC name of piperidin-1-yl N-piperidin-1-ylcarbamate (CID 57271004) is piperidin-1-yl N-piperidin-1-ylcarbamate.
What is the SMILES notation for piperidin-1-yl N-piperidin-1-ylcarbamate?
The canonical SMILES for piperidin-1-yl N-piperidin-1-ylcarbamate is O=C(NN1CCCCC1)ON1CCCCC1.
What is the InChIKey of piperidin-1-yl N-piperidin-1-ylcarbamate?
The InChIKey is ATAQBXLQOALOFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c15-11(12-13-7-3-1-4-8-13)16-14-9-5-2-6-10-14/h1-10H2,(H,12,15).
What are the key properties of piperidin-1-yl N-piperidin-1-ylcarbamate?
piperidin-1-yl N-piperidin-1-ylcarbamate has a molecular weight of 227.31 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-1-yl N-piperidin-1-ylcarbamate is sourced from PubChem (CID 57271004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).