[1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride

C12H19ClN2O — CID 167311617

IUPAC[1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride
SMILESCl.OCC1CCCN(Cc2ccccn2)C1
InChIInChI=1S/C12H18N2O.ClH/c15-10-11-4-3-7-14(8-11)9-12-5-1-2-6-13-12;/h1-2,5-6,11,15H,3-4,7-10H2;1H
InChIKeyIGMBAFQKCPALLB-UHFFFAOYSA-N
MW242.75 g/mol
LogP1.71
Rot. Bonds3

About [1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride

[1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride (PubChem CID 167311617) has the molecular formula C12H19ClN2O and a molecular weight of 242.75 g/mol. Its IUPAC name is [1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride.

Molecular Properties

Compound Name[1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride
PubChem CID167311617
Molecular FormulaC12H19ClN2O
Molecular Weight242.75 g/mol
Exact Mass242.12
IUPAC Name[1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride
SMILESCl.OCC1CCCN(Cc2ccccn2)C1
InChIInChI=1S/C12H18N2O.ClH/c15-10-11-4-3-7-14(8-11)9-12-5-1-2-6-13-12;/h1-2,5-6,11,15H,3-4,7-10H2;1H
InChIKeyIGMBAFQKCPALLB-UHFFFAOYSA-N
XLogP1.71
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.75
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]methyl]pyridine
CID 95844895
(3S)-1-(pyridin-2-ylmethyl)piperidin-3-amine
CID 39221497
2-[(3-chloropiperidin-1-yl)methyl]pyridine
CID 63386992
N-[2-[(3S)-3-(hydroxymethyl)piperidin-1-yl]ethyl]-4-(pyridin-2-ylmethyl)-1,4-diazepane-1-carboxamide
CID 126426454
[1-(pyridin-2-ylmethyl)pyrrolidin-3-yl]methanamine;hydrochloride
CID 71644926
[1-[[2-(aminomethyl)-4-pyridinyl]methyl]piperidin-3-yl]methanol
CID 63887461
1-benzyl-3-[[(3S)-1-(pyridin-2-ylmethyl)piperidin-3-yl]methyl]urea
CID 95201612
2-oxo-N-[[(3S)-1-(pyridin-2-ylmethyl)piperidin-3-yl]methyl]butanamide
CID 95227434
N'-hydroxy-1-(pyridin-2-ylmethyl)piperidine-3-carboximidamide
CID 77041469
2-[[(3S)-3-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]piperidin-1-yl]methyl]pyridine
CID 95317619
azepan-1-yl-[1-(pyridin-2-ylmethyl)piperidin-3-yl]methanone
CID 5116844
[1-[[6-(methylamino)-2-pyridinyl]methyl]piperidin-3-yl]methanol
CID 79242797

Frequently Asked Questions

What is the IUPAC name of [1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride?
The IUPAC name of [1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride (CID 167311617) is [1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride.
What is the SMILES notation for [1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride?
The canonical SMILES for [1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride is Cl.OCC1CCCN(Cc2ccccn2)C1.
What is the InChIKey of [1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride?
The InChIKey is IGMBAFQKCPALLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O.ClH/c15-10-11-4-3-7-14(8-11)9-12-5-1-2-6-13-12;/h1-2,5-6,11,15H,3-4,7-10H2;1H.
What are the key properties of [1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride?
[1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride has a molecular weight of 242.75 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride is sourced from PubChem (CID 167311617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).