4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine

C11H22FNO — CID 58365091

IUPAC4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine
SMILESCN1CCC(F)(COC(C)(C)C)CC1
InChIInChI=1S/C11H22FNO/c1-10(2,3)14-9-11(12)5-7-13(4)8-6-11/h5-9H2,1-4H3
InChIKeyQLGJJFOMNDSMIK-UHFFFAOYSA-N
MW203.30 g/mol
LogP2.24
Rot. Bonds2

About 4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine

4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine (PubChem CID 58365091) has the molecular formula C11H22FNO and a molecular weight of 203.30 g/mol. Its IUPAC name is 4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine.

Molecular Properties

Compound Name4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine
PubChem CID58365091
Molecular FormulaC11H22FNO
Molecular Weight203.30 g/mol
Exact Mass203.17
IUPAC Name4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine
SMILESCN1CCC(F)(COC(C)(C)C)CC1
InChIInChI=1S/C11H22FNO/c1-10(2,3)14-9-11(12)5-7-13(4)8-6-11/h5-9H2,1-4H3
InChIKeyQLGJJFOMNDSMIK-UHFFFAOYSA-N
XLogP2.24
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.30
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]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-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The IUPAC name of 4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine (CID 58365091) is 4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine.
What is the SMILES notation for 4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The canonical SMILES for 4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine is CN1CCC(F)(COC(C)(C)C)CC1.
What is the InChIKey of 4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine?
The InChIKey is QLGJJFOMNDSMIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22FNO/c1-10(2,3)14-9-11(12)5-7-13(4)8-6-11/h5-9H2,1-4H3.
What are the key properties of 4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine?
4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine has a molecular weight of 203.30 g/mol, XLogP of 2.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-methyl-4-[(2-methylpropan-2-yl)oxymethyl]piperidine is sourced from PubChem (CID 58365091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).