4-[2-(cyclohexylmethoxy)ethyl]piperidine

C14H27NO — CID 62383196

IUPAC4-[2-(cyclohexylmethoxy)ethyl]piperidine
SMILESC1CCC(COCCC2CCNCC2)CC1
InChIInChI=1S/C14H27NO/c1-2-4-14(5-3-1)12-16-11-8-13-6-9-15-10-7-13/h13-15H,1-12H2
InChIKeyDPSFVRXZSMLRSI-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds5

About 4-[2-(cyclohexylmethoxy)ethyl]piperidine

4-[2-(cyclohexylmethoxy)ethyl]piperidine (PubChem CID 62383196) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 4-[2-(cyclohexylmethoxy)ethyl]piperidine.

Molecular Properties

Compound Name4-[2-(cyclohexylmethoxy)ethyl]piperidine
PubChem CID62383196
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name4-[2-(cyclohexylmethoxy)ethyl]piperidine
SMILESC1CCC(COCCC2CCNCC2)CC1
InChIInChI=1S/C14H27NO/c1-2-4-14(5-3-1)12-16-11-8-13-6-9-15-10-7-13/h13-15H,1-12H2
InChIKeyDPSFVRXZSMLRSI-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(cyclohexylmethoxy)ethyl]piperidine?
The IUPAC name of 4-[2-(cyclohexylmethoxy)ethyl]piperidine (CID 62383196) is 4-[2-(cyclohexylmethoxy)ethyl]piperidine.
What is the SMILES notation for 4-[2-(cyclohexylmethoxy)ethyl]piperidine?
The canonical SMILES for 4-[2-(cyclohexylmethoxy)ethyl]piperidine is C1CCC(COCCC2CCNCC2)CC1.
What is the InChIKey of 4-[2-(cyclohexylmethoxy)ethyl]piperidine?
The InChIKey is DPSFVRXZSMLRSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-2-4-14(5-3-1)12-16-11-8-13-6-9-15-10-7-13/h13-15H,1-12H2.
What are the key properties of 4-[2-(cyclohexylmethoxy)ethyl]piperidine?
4-[2-(cyclohexylmethoxy)ethyl]piperidine has a molecular weight of 225.38 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(cyclohexylmethoxy)ethyl]piperidine is sourced from PubChem (CID 62383196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).