[(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol

C11H15FN2O — CID 94573932

IUPAC[(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol
SMILESOC[C@H]1CCCN(c2ncccc2F)C1
InChIInChI=1S/C11H15FN2O/c12-10-4-1-5-13-11(10)14-6-2-3-9(7-14)8-15/h1,4-5,9,15H,2-3,6-8H2/t9-/m0/s1
InChIKeyQSWQKELMXCKXMP-VIFPVBQESA-N
MW210.25 g/mol
LogP1.43
Rot. Bonds2

About [(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol

[(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol (PubChem CID 94573932) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is [(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol
PubChem CID94573932
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC Name[(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol
SMILESOC[C@H]1CCCN(c2ncccc2F)C1
InChIInChI=1S/C11H15FN2O/c12-10-4-1-5-13-11(10)14-6-2-3-9(7-14)8-15/h1,4-5,9,15H,2-3,6-8H2/t9-/m0/s1
InChIKeyQSWQKELMXCKXMP-VIFPVBQESA-N
XLogP1.43
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(3-methyl-2-pyridinyl)piperidin-3-yl]methanol
CID 62253909
2-[3-(hydroxymethyl)piperidin-1-yl]pyridine-3-carboxylic acid
CID 43403358
2-[[1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methoxy]pyrazine
CID 163354536
[1-[(3-fluoro-2-pyridinyl)sulfonyl]piperidin-3-yl]methanol
CID 103299267
2-[(3S)-3-(hydroxymethyl)piperidin-1-yl]-N-propylpyridine-3-carboxamide
CID 39834364
[2-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol
CID 61256468
methyl 1-(3-fluoro-2-pyridinyl)piperidine-3-carboxylate
CID 115538419
N-cyclohexyl-N-[3-[1-(3-fluoro-2-pyridinyl)piperidin-3-yl]propyl]formamide
CID 143229815
2-[1-(3-ethoxy-2-pyridinyl)piperidin-3-yl]ethanol
CID 113371177
2-(3-bromopyrrolidin-1-yl)-3-fluoropyridine
CID 80666888
N-[1-(3-fluoro-2-pyridinyl)piperidin-3-yl]-2,2-dimethylpropanamide
CID 163357585
2-[(3S)-3-[2-(2-fluorophenyl)ethyl]piperidin-1-yl]pyridine-3-carboxamide
CID 95869834

Frequently Asked Questions

What is the IUPAC name of [(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol?
The IUPAC name of [(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol (CID 94573932) is [(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol.
What is the SMILES notation for [(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol?
The canonical SMILES for [(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol is OC[C@H]1CCCN(c2ncccc2F)C1.
What is the InChIKey of [(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol?
The InChIKey is QSWQKELMXCKXMP-VIFPVBQESA-N. The full InChI is InChI=1S/C11H15FN2O/c12-10-4-1-5-13-11(10)14-6-2-3-9(7-14)8-15/h1,4-5,9,15H,2-3,6-8H2/t9-/m0/s1.
What are the key properties of [(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol?
[(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol has a molecular weight of 210.25 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]methanol is sourced from PubChem (CID 94573932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).