1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol

C12H18N2O2 — CID 102964194

IUPAC1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol
SMILESCC1CCN(c2cccc(CO)n2)CC1O
InChIInChI=1S/C12H18N2O2/c1-9-5-6-14(7-11(9)16)12-4-2-3-10(8-15)13-12/h2-4,9,11,15-16H,5-8H2,1H3
InChIKeyJMQXENZUHDQEFR-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.78
Rot. Bonds2

About 1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol

1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol (PubChem CID 102964194) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol.

Molecular Properties

Compound Name1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol
PubChem CID102964194
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol
SMILESCC1CCN(c2cccc(CO)n2)CC1O
InChIInChI=1S/C12H18N2O2/c1-9-5-6-14(7-11(9)16)12-4-2-3-10(8-15)13-12/h2-4,9,11,15-16H,5-8H2,1H3
InChIKeyJMQXENZUHDQEFR-UHFFFAOYSA-N
XLogP0.78
TPSA56.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[6-[3-(methoxymethyl)piperidin-1-yl]-2-pyridinyl]methanol
CID 106588319
[6-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-2-pyridinyl]methanol
CID 63150729
2-[1-[6-(hydroxymethyl)-2-pyridinyl]piperidin-3-yl]ethanol
CID 107228577
[6-(azocan-1-yl)-2-pyridinyl]methanol
CID 62253750
1-[6-(propan-2-yloxymethyl)-2-pyridinyl]pyrrolidin-3-ol
CID 164738532
2-(chloromethyl)-6-(3-methylpyrrolidin-1-yl)pyridine
CID 62255365
4-methyl-1-(2-methylpyrimidin-4-yl)piperidin-3-ol
CID 103896105
[6-(2-methylpiperidin-1-yl)-2-pyridinyl]methanol
CID 62253556
N-[[6-(3-methoxy-4-methylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine
CID 102967645
methyl 2-[1-[6-(hydroxymethyl)-2-pyridinyl]piperidin-4-yl]acetate
CID 135277813
2-(chloromethyl)-6-(3,4-dimethylpyrrolidin-1-yl)pyridine
CID 79184553
1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol
CID 114679698

Frequently Asked Questions

What is the IUPAC name of 1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol?
The IUPAC name of 1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol (CID 102964194) is 1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol.
What is the SMILES notation for 1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol?
The canonical SMILES for 1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol is CC1CCN(c2cccc(CO)n2)CC1O.
What is the InChIKey of 1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol?
The InChIKey is JMQXENZUHDQEFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9-5-6-14(7-11(9)16)12-4-2-3-10(8-15)13-12/h2-4,9,11,15-16H,5-8H2,1H3.
What are the key properties of 1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol?
1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol has a molecular weight of 222.29 g/mol, XLogP of 0.78, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(hydroxymethyl)-2-pyridinyl]-4-methylpiperidin-3-ol is sourced from PubChem (CID 102964194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).