4-methyl-1-(oxan-4-yl)piperidine

C11H21NO — CID 20758866

IUPAC4-methyl-1-(oxan-4-yl)piperidine
SMILESCC1CCN(C2CCOCC2)CC1
InChIInChI=1S/C11H21NO/c1-10-2-6-12(7-3-10)11-4-8-13-9-5-11/h10-11H,2-9H2,1H3
InChIKeyNYWMJHQGWZSPFT-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.90
Rot. Bonds1

About 4-methyl-1-(oxan-4-yl)piperidine

4-methyl-1-(oxan-4-yl)piperidine (PubChem CID 20758866) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-methyl-1-(oxan-4-yl)piperidine.

Molecular Properties

Compound Name4-methyl-1-(oxan-4-yl)piperidine
PubChem CID20758866
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-methyl-1-(oxan-4-yl)piperidine
SMILESCC1CCN(C2CCOCC2)CC1
InChIInChI=1S/C11H21NO/c1-10-2-6-12(7-3-10)11-4-8-13-9-5-11/h10-11H,2-9H2,1H3
InChIKeyNYWMJHQGWZSPFT-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
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

Analyze 4-methyl-1-(oxan-4-yl)piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(oxan-4-yl)piperidine?
The IUPAC name of 4-methyl-1-(oxan-4-yl)piperidine (CID 20758866) is 4-methyl-1-(oxan-4-yl)piperidine.
What is the SMILES notation for 4-methyl-1-(oxan-4-yl)piperidine?
The canonical SMILES for 4-methyl-1-(oxan-4-yl)piperidine is CC1CCN(C2CCOCC2)CC1.
What is the InChIKey of 4-methyl-1-(oxan-4-yl)piperidine?
The InChIKey is NYWMJHQGWZSPFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10-2-6-12(7-3-10)11-4-8-13-9-5-11/h10-11H,2-9H2,1H3.
What are the key properties of 4-methyl-1-(oxan-4-yl)piperidine?
4-methyl-1-(oxan-4-yl)piperidine has a molecular weight of 183.29 g/mol, XLogP of 1.90, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(oxan-4-yl)piperidine is sourced from PubChem (CID 20758866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).