4-methyl-1-(oxetan-3-ylmethyl)piperidine

C10H19NO — CID 130694292

IUPAC4-methyl-1-(oxetan-3-ylmethyl)piperidine
SMILESCC1CCN(CC2COC2)CC1
InChIInChI=1S/C10H19NO/c1-9-2-4-11(5-3-9)6-10-7-12-8-10/h9-10H,2-8H2,1H3
InChIKeyCMYUDHIZJBWVCP-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.36
Rot. Bonds2

About 4-methyl-1-(oxetan-3-ylmethyl)piperidine

4-methyl-1-(oxetan-3-ylmethyl)piperidine (PubChem CID 130694292) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 4-methyl-1-(oxetan-3-ylmethyl)piperidine.

Molecular Properties

Compound Name4-methyl-1-(oxetan-3-ylmethyl)piperidine
PubChem CID130694292
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name4-methyl-1-(oxetan-3-ylmethyl)piperidine
SMILESCC1CCN(CC2COC2)CC1
InChIInChI=1S/C10H19NO/c1-9-2-4-11(5-3-9)6-10-7-12-8-10/h9-10H,2-8H2,1H3
InChIKeyCMYUDHIZJBWVCP-UHFFFAOYSA-N
XLogP1.36
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(oxetan-3-ylmethyl)piperidine?
The IUPAC name of 4-methyl-1-(oxetan-3-ylmethyl)piperidine (CID 130694292) is 4-methyl-1-(oxetan-3-ylmethyl)piperidine.
What is the SMILES notation for 4-methyl-1-(oxetan-3-ylmethyl)piperidine?
The canonical SMILES for 4-methyl-1-(oxetan-3-ylmethyl)piperidine is CC1CCN(CC2COC2)CC1.
What is the InChIKey of 4-methyl-1-(oxetan-3-ylmethyl)piperidine?
The InChIKey is CMYUDHIZJBWVCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-9-2-4-11(5-3-9)6-10-7-12-8-10/h9-10H,2-8H2,1H3.
What are the key properties of 4-methyl-1-(oxetan-3-ylmethyl)piperidine?
4-methyl-1-(oxetan-3-ylmethyl)piperidine has a molecular weight of 169.27 g/mol, XLogP of 1.36, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(oxetan-3-ylmethyl)piperidine is sourced from PubChem (CID 130694292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).