piperidin-3-yl cyclopentanecarboxylate

C11H19NO2 — CID 56829579

IUPACpiperidin-3-yl cyclopentanecarboxylate
SMILESO=C(OC1CCCNC1)C1CCCC1
InChIInChI=1S/C11H19NO2/c13-11(9-4-1-2-5-9)14-10-6-3-7-12-8-10/h9-10,12H,1-8H2
InChIKeyIHQCBFBVOUGSAN-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.47
Rot. Bonds2

About piperidin-3-yl cyclopentanecarboxylate

piperidin-3-yl cyclopentanecarboxylate (PubChem CID 56829579) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is piperidin-3-yl cyclopentanecarboxylate.

Molecular Properties

Compound Namepiperidin-3-yl cyclopentanecarboxylate
PubChem CID56829579
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Namepiperidin-3-yl cyclopentanecarboxylate
SMILESO=C(OC1CCCNC1)C1CCCC1
InChIInChI=1S/C11H19NO2/c13-11(9-4-1-2-5-9)14-10-6-3-7-12-8-10/h9-10,12H,1-8H2
InChIKeyIHQCBFBVOUGSAN-UHFFFAOYSA-N
XLogP1.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

piperidin-3-yl cyclobutanecarboxylate;hydrochloride
CID 53409783
cyclopentyl piperidine-3-carboxylate
CID 61278605
cyclohexyl (3S)-piperidine-3-carboxylate
CID 81126068
cycloheptyl pyrrolidine-3-carboxylate
CID 63033044
cyclooctyl cyclooctanecarboxylate
CID 57160377
[(3S)-pyrrolidin-3-yl] (3S)-pyrrolidine-3-carboxylate
CID 140571611
[(3S)-pyrrolidin-3-yl] oxane-4-carboxylate
CID 86319568
(3-ethylcyclohexyl) (3R)-piperidine-3-carboxylate
CID 81121055
[4-(cyclohexanecarbonyloxy)cyclohexyl] cyclohexanecarboxylate
CID 118132173
cyclopentyl 1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-5-carboxylate
CID 25094738
piperidin-3-yl 2-methylpropanoate
CID 53409773
azepan-3-yl 2,2-dimethylpropanoate
CID 174683431

Frequently Asked Questions

What is the IUPAC name of piperidin-3-yl cyclopentanecarboxylate?
The IUPAC name of piperidin-3-yl cyclopentanecarboxylate (CID 56829579) is piperidin-3-yl cyclopentanecarboxylate.
What is the SMILES notation for piperidin-3-yl cyclopentanecarboxylate?
The canonical SMILES for piperidin-3-yl cyclopentanecarboxylate is O=C(OC1CCCNC1)C1CCCC1.
What is the InChIKey of piperidin-3-yl cyclopentanecarboxylate?
The InChIKey is IHQCBFBVOUGSAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c13-11(9-4-1-2-5-9)14-10-6-3-7-12-8-10/h9-10,12H,1-8H2.
What are the key properties of piperidin-3-yl cyclopentanecarboxylate?
piperidin-3-yl cyclopentanecarboxylate has a molecular weight of 197.28 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-3-yl cyclopentanecarboxylate is sourced from PubChem (CID 56829579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).