4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine

C11H22FNO — CID 129145289

IUPAC4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
SMILESCC(C)(C)OCCN1CCC(F)CC1
InChIInChI=1S/C11H22FNO/c1-11(2,3)14-9-8-13-6-4-10(12)5-7-13/h10H,4-9H2,1-3H3
InChIKeyCQALCZKFJWUGTO-UHFFFAOYSA-N
MW203.30 g/mol
LogP2.24
Rot. Bonds3

About 4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine

4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine (PubChem CID 129145289) has the molecular formula C11H22FNO and a molecular weight of 203.30 g/mol. Its IUPAC name is 4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine.

Molecular Properties

Compound Name4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
PubChem CID129145289
Molecular FormulaC11H22FNO
Molecular Weight203.30 g/mol
Exact Mass203.17
IUPAC Name4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
SMILESCC(C)(C)OCCN1CCC(F)CC1
InChIInChI=1S/C11H22FNO/c1-11(2,3)14-9-8-13-6-4-10(12)5-7-13/h10H,4-9H2,1-3H3
InChIKeyCQALCZKFJWUGTO-UHFFFAOYSA-N
XLogP2.24
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
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

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine?
The IUPAC name of 4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine (CID 129145289) is 4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine.
What is the SMILES notation for 4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine?
The canonical SMILES for 4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine is CC(C)(C)OCCN1CCC(F)CC1.
What is the InChIKey of 4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine?
The InChIKey is CQALCZKFJWUGTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22FNO/c1-11(2,3)14-9-8-13-6-4-10(12)5-7-13/h10H,4-9H2,1-3H3.
What are the key properties of 4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine?
4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine has a molecular weight of 203.30 g/mol, XLogP of 2.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine is sourced from PubChem (CID 129145289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).