5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine

C11H21NO — CID 122432525

IUPAC5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine
SMILESCCC1CCC(C)N(C2COC2)C1
InChIInChI=1S/C11H21NO/c1-3-10-5-4-9(2)12(6-10)11-7-13-8-11/h9-11H,3-8H2,1-2H3
InChIKeyASQXMGPQVPFNIL-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.90
Rot. Bonds2

About 5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine

5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine (PubChem CID 122432525) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine.

Molecular Properties

Compound Name5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine
PubChem CID122432525
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine
SMILESCCC1CCC(C)N(C2COC2)C1
InChIInChI=1S/C11H21NO/c1-3-10-5-4-9(2)12(6-10)11-7-13-8-11/h9-11H,3-8H2,1-2H3
InChIKeyASQXMGPQVPFNIL-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine?
The IUPAC name of 5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine (CID 122432525) is 5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine.
What is the SMILES notation for 5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine?
The canonical SMILES for 5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine is CCC1CCC(C)N(C2COC2)C1.
What is the InChIKey of 5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine?
The InChIKey is ASQXMGPQVPFNIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-3-10-5-4-9(2)12(6-10)11-7-13-8-11/h9-11H,3-8H2,1-2H3.
What are the key properties of 5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine?
5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine has a molecular weight of 183.29 g/mol, XLogP of 1.90, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methyl-1-(oxetan-3-yl)piperidine is sourced from PubChem (CID 122432525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).