4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine

C11H21NO — CID 129125914

IUPAC4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine
SMILESCCC1(C)CCN(C2COC2)CC1
InChIInChI=1S/C11H21NO/c1-3-11(2)4-6-12(7-5-11)10-8-13-9-10/h10H,3-9H2,1-2H3
InChIKeyUAFODODAQJHSRZ-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.90
Rot. Bonds2

About 4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine

4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine (PubChem CID 129125914) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine.

Molecular Properties

Compound Name4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine
PubChem CID129125914
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine
SMILESCCC1(C)CCN(C2COC2)CC1
InChIInChI=1S/C11H21NO/c1-3-11(2)4-6-12(7-5-11)10-8-13-9-10/h10H,3-9H2,1-2H3
InChIKeyUAFODODAQJHSRZ-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 4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine?
The IUPAC name of 4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine (CID 129125914) is 4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine.
What is the SMILES notation for 4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine?
The canonical SMILES for 4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine is CCC1(C)CCN(C2COC2)CC1.
What is the InChIKey of 4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine?
The InChIKey is UAFODODAQJHSRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-3-11(2)4-6-12(7-5-11)10-8-13-9-10/h10H,3-9H2,1-2H3.
What are the key properties of 4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine?
4-ethyl-4-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 4-ethyl-4-methyl-1-(oxetan-3-yl)piperidine is sourced from PubChem (CID 129125914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).