cyclopentylmethyl N-piperidin-4-ylcarbamate

C12H22N2O2 — CID 15676973

IUPACcyclopentylmethyl N-piperidin-4-ylcarbamate
SMILESO=C(NC1CCNCC1)OCC1CCCC1
InChIInChI=1S/C12H22N2O2/c15-12(14-11-5-7-13-8-6-11)16-9-10-3-1-2-4-10/h10-11,13H,1-9H2,(H,14,15)
InChIKeyPYPOCLHGDXXACE-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.65
Rot. Bonds3

About cyclopentylmethyl N-piperidin-4-ylcarbamate

cyclopentylmethyl N-piperidin-4-ylcarbamate (PubChem CID 15676973) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is cyclopentylmethyl N-piperidin-4-ylcarbamate.

Molecular Properties

Compound Namecyclopentylmethyl N-piperidin-4-ylcarbamate
PubChem CID15676973
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Namecyclopentylmethyl N-piperidin-4-ylcarbamate
SMILESO=C(NC1CCNCC1)OCC1CCCC1
InChIInChI=1S/C12H22N2O2/c15-12(14-11-5-7-13-8-6-11)16-9-10-3-1-2-4-10/h10-11,13H,1-9H2,(H,14,15)
InChIKeyPYPOCLHGDXXACE-UHFFFAOYSA-N
XLogP1.65
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclopentylmethyl N-piperidin-4-ylcarbamate?
The IUPAC name of cyclopentylmethyl N-piperidin-4-ylcarbamate (CID 15676973) is cyclopentylmethyl N-piperidin-4-ylcarbamate.
What is the SMILES notation for cyclopentylmethyl N-piperidin-4-ylcarbamate?
The canonical SMILES for cyclopentylmethyl N-piperidin-4-ylcarbamate is O=C(NC1CCNCC1)OCC1CCCC1.
What is the InChIKey of cyclopentylmethyl N-piperidin-4-ylcarbamate?
The InChIKey is PYPOCLHGDXXACE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c15-12(14-11-5-7-13-8-6-11)16-9-10-3-1-2-4-10/h10-11,13H,1-9H2,(H,14,15).
What are the key properties of cyclopentylmethyl N-piperidin-4-ylcarbamate?
cyclopentylmethyl N-piperidin-4-ylcarbamate has a molecular weight of 226.32 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentylmethyl N-piperidin-4-ylcarbamate is sourced from PubChem (CID 15676973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).