[(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol

C11H16N2O — CID 86336410

IUPAC[(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol
SMILESOC[C@@H]1CCCCN1c1cccnc1
InChIInChI=1S/C11H16N2O/c14-9-11-4-1-2-7-13(11)10-5-3-6-12-8-10/h3,5-6,8,11,14H,1-2,4,7,9H2/t11-/m0/s1
InChIKeyCZIYNEQPVGDEDC-NSHDSACASA-N
MW192.26 g/mol
LogP1.43
Rot. Bonds2

About [(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol

[(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol (PubChem CID 86336410) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is [(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol.

Molecular Properties

Compound Name[(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol
PubChem CID86336410
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name[(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol
SMILESOC[C@@H]1CCCCN1c1cccnc1
InChIInChI=1S/C11H16N2O/c14-9-11-4-1-2-7-13(11)10-5-3-6-12-8-10/h3,5-6,8,11,14H,1-2,4,7,9H2/t11-/m0/s1
InChIKeyCZIYNEQPVGDEDC-NSHDSACASA-N
XLogP1.43
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-pyridin-3-ylpyrrolidin-2-ol
CID 139888349
2-[(2S)-2-(hydroxymethyl)piperidin-1-yl]pyridin-3-ol
CID 97169524
[1-[3-(hydroxymethyl)-4-pyridinyl]azepan-2-yl]methanol
CID 116637094
1-pyridin-3-ylpyrrolidin-2-amine
CID 54403911
[1-(3-amino-2-pyridinyl)piperidin-2-yl]methanol
CID 61406906
[1-(2-chloro-4-pyridinyl)azepan-2-yl]methanol
CID 102824406
[1-(5-bromo-3-pyridinyl)pyrrolidin-2-yl]methanol
CID 89439842
3-[2-(hydroxymethyl)azepan-1-yl]pyridine-4-carbonitrile
CID 116634705
[1-[6-[(1R)-1-aminoethyl]-3-pyridinyl]piperidin-2-yl]methanol
CID 83122235
5-[2-(hydroxymethyl)azepan-1-yl]pyridine-2-carbothioamide
CID 116634835
3-[2-(hydroxymethyl)piperidin-1-yl]benzonitrile
CID 12018198
[1-[3-(aminomethyl)-2-pyridinyl]piperidin-2-yl]methanol
CID 61407036

Frequently Asked Questions

What is the IUPAC name of [(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol?
The IUPAC name of [(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol (CID 86336410) is [(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol.
What is the SMILES notation for [(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol?
The canonical SMILES for [(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol is OC[C@@H]1CCCCN1c1cccnc1.
What is the InChIKey of [(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol?
The InChIKey is CZIYNEQPVGDEDC-NSHDSACASA-N. The full InChI is InChI=1S/C11H16N2O/c14-9-11-4-1-2-7-13(11)10-5-3-6-12-8-10/h3,5-6,8,11,14H,1-2,4,7,9H2/t11-/m0/s1.
What are the key properties of [(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol?
[(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol has a molecular weight of 192.26 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 [(2S)-1-pyridin-3-ylpiperidin-2-yl]methanol is sourced from PubChem (CID 86336410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).