3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine

C11H18FNO — CID 102648250

IUPAC3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine
SMILESFC(C1=CCCCO1)C1CCCNC1
InChIInChI=1S/C11H18FNO/c12-11(9-4-3-6-13-8-9)10-5-1-2-7-14-10/h5,9,11,13H,1-4,6-8H2
InChIKeyXKRORMGOKKIYMZ-UHFFFAOYSA-N
MW199.27 g/mol
LogP2.02
Rot. Bonds2

About 3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine

3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine (PubChem CID 102648250) has the molecular formula C11H18FNO and a molecular weight of 199.27 g/mol. Its IUPAC name is 3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine.

Molecular Properties

Compound Name3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine
PubChem CID102648250
Molecular FormulaC11H18FNO
Molecular Weight199.27 g/mol
Exact Mass199.14
IUPAC Name3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine
SMILESFC(C1=CCCCO1)C1CCCNC1
InChIInChI=1S/C11H18FNO/c12-11(9-4-3-6-13-8-9)10-5-1-2-7-14-10/h5,9,11,13H,1-4,6-8H2
InChIKeyXKRORMGOKKIYMZ-UHFFFAOYSA-N
XLogP2.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.27
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3,4-dihydro-2H-pyran-6-yl)-3-fluoropiperidine
CID 102648241
4-(3,4-dihydro-2H-pyran-6-yl)-4-fluoropiperidine
CID 102648242
4-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine
CID 102648244
3-[1-(3,4-dihydro-2H-pyran-6-yl)-1-fluoroethyl]piperidine
CID 102648248
2-[2-(3,4-dihydro-2H-pyran-6-yl)-2-fluoropropyl]piperidine
CID 102648262
4-[2,3-Dihydrofuran-5-yl(fluoro)methyl]piperidine
CID 102652367
3-[1-(2,3-Dihydrofuran-5-yl)-1-fluoroethyl]piperidine
CID 102652371
3-[2,3-Dihydrofuran-5-yl(fluoro)methyl]piperidine
CID 102652373
4-[(4R)-4-methylcyclohexen-1-yl]oxypiperidine
CID 68082956
4-[(4R)-4-propan-2-ylcyclohexen-1-yl]oxypiperidine
CID 68083152
2-(1-Piperidin-4-ylethenoxy)cyclohexen-1-amine
CID 68083186
4-(1-Ethoxyprop-1-enyl)piperidine
CID 90986736

Frequently Asked Questions

What is the IUPAC name of 3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine?
The IUPAC name of 3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine (CID 102648250) is 3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine.
What is the SMILES notation for 3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine?
The canonical SMILES for 3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine is FC(C1=CCCCO1)C1CCCNC1.
What is the InChIKey of 3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine?
The InChIKey is XKRORMGOKKIYMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18FNO/c12-11(9-4-3-6-13-8-9)10-5-1-2-7-14-10/h5,9,11,13H,1-4,6-8H2.
What are the key properties of 3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine?
3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine has a molecular weight of 199.27 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine is sourced from PubChem (CID 102648250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).