3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine

C12H17FN2O — CID 106634961

IUPAC3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine
SMILESCOc1cncc(C(F)C2CCCCN2)c1
InChIInChI=1S/C12H17FN2O/c1-16-10-6-9(7-14-8-10)12(13)11-4-2-3-5-15-11/h6-8,11-12,15H,2-5H2,1H3
InChIKeyUKJPECDCNDACJU-UHFFFAOYSA-N
MW224.28 g/mol
LogP2.24
Rot. Bonds3

About 3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine

3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine (PubChem CID 106634961) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is 3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine.

Molecular Properties

Compound Name3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine
PubChem CID106634961
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC Name3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine
SMILESCOc1cncc(C(F)C2CCCCN2)c1
InChIInChI=1S/C12H17FN2O/c1-16-10-6-9(7-14-8-10)12(13)11-4-2-3-5-15-11/h6-8,11-12,15H,2-5H2,1H3
InChIKeyUKJPECDCNDACJU-UHFFFAOYSA-N
XLogP2.24
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

piperidin-2-yl-(5-propan-2-yloxy-3-pyridinyl)methanol
CID 106634630
2-[fluoro-(4-methoxy-2-methylphenyl)methyl]piperidine
CID 106635068
(5-propan-2-yloxy-3-pyridinyl)-pyrrolidin-2-ylmethanol
CID 106639944
(3-methoxyphenyl)-[(2S)-piperidin-2-yl]methanol
CID 69187424
(S)-(3,5-dimethoxyphenyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 135313109
2-[fluoro-(5-methylthiophen-3-yl)methyl]piperidine
CID 106635079
3-methoxy-5-[(2R)-pyrrolidin-2-yl]pyridine
CID 130624742
2-[fluoro-(3-propan-2-yloxyphenyl)methyl]pyrrolidine
CID 106640253
2-[fluoro(piperidin-2-yl)methyl]pyrazine
CID 106635051
[cyclooctyl-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105255257
2,2-difluoro-1-(5-methoxy-3-pyridinyl)ethanol
CID 112575542
(5-methoxy-3-pyridinyl)-(oxan-2-yl)methanol
CID 115828914

Frequently Asked Questions

What is the IUPAC name of 3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine?
The IUPAC name of 3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine (CID 106634961) is 3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine.
What is the SMILES notation for 3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine?
The canonical SMILES for 3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine is COc1cncc(C(F)C2CCCCN2)c1.
What is the InChIKey of 3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine?
The InChIKey is UKJPECDCNDACJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c1-16-10-6-9(7-14-8-10)12(13)11-4-2-3-5-15-11/h6-8,11-12,15H,2-5H2,1H3.
What are the key properties of 3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine?
3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine has a molecular weight of 224.28 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine is sourced from PubChem (CID 106634961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).