cyclohexyl piperidine-2-carboxylate

C12H21NO2 — CID 61277188

IUPACcyclohexyl piperidine-2-carboxylate
SMILESO=C(OC1CCCCC1)C1CCCCN1
InChIInChI=1S/C12H21NO2/c14-12(11-8-4-5-9-13-11)15-10-6-2-1-3-7-10/h10-11,13H,1-9H2
InChIKeyLLBOJBQAKQOPPH-UHFFFAOYSA-N
MW211.30 g/mol
LogP2.00
Rot. Bonds2

About cyclohexyl piperidine-2-carboxylate

cyclohexyl piperidine-2-carboxylate (PubChem CID 61277188) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is cyclohexyl piperidine-2-carboxylate.

Molecular Properties

Compound Namecyclohexyl piperidine-2-carboxylate
PubChem CID61277188
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC Namecyclohexyl piperidine-2-carboxylate
SMILESO=C(OC1CCCCC1)C1CCCCN1
InChIInChI=1S/C12H21NO2/c14-12(11-8-4-5-9-13-11)15-10-6-2-1-3-7-10/h10-11,13H,1-9H2
InChIKeyLLBOJBQAKQOPPH-UHFFFAOYSA-N
XLogP2.00
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl piperidine-2-carboxylate?
The IUPAC name of cyclohexyl piperidine-2-carboxylate (CID 61277188) is cyclohexyl piperidine-2-carboxylate.
What is the SMILES notation for cyclohexyl piperidine-2-carboxylate?
The canonical SMILES for cyclohexyl piperidine-2-carboxylate is O=C(OC1CCCCC1)C1CCCCN1.
What is the InChIKey of cyclohexyl piperidine-2-carboxylate?
The InChIKey is LLBOJBQAKQOPPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c14-12(11-8-4-5-9-13-11)15-10-6-2-1-3-7-10/h10-11,13H,1-9H2.
What are the key properties of cyclohexyl piperidine-2-carboxylate?
cyclohexyl piperidine-2-carboxylate has a molecular weight of 211.30 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl piperidine-2-carboxylate is sourced from PubChem (CID 61277188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).