2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol

C18H22N2O2 — CID 612056

IUPAC2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol
SMILESCOc1ccc(-c2nc(CN3CCCCC3)ccc2O)cc1
InChIInChI=1S/C18H22N2O2/c1-22-16-8-5-14(6-9-16)18-17(21)10-7-15(19-18)13-20-11-3-2-4-12-20/h5-10,21H,2-4,11-13H2,1H3
InChIKeyGVHFIOFXWMUXGR-UHFFFAOYSA-N
MW298.39 g/mol
LogP3.45
Rot. Bonds4

About 2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol

2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol (PubChem CID 612056) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol
PubChem CID612056
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol
SMILESCOc1ccc(-c2nc(CN3CCCCC3)ccc2O)cc1
InChIInChI=1S/C18H22N2O2/c1-22-16-8-5-14(6-9-16)18-17(21)10-7-15(19-18)13-20-11-3-2-4-12-20/h5-10,21H,2-4,11-13H2,1H3
InChIKeyGVHFIOFXWMUXGR-UHFFFAOYSA-N
XLogP3.45
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol?
The IUPAC name of 2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol (CID 612056) is 2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol.
What is the SMILES notation for 2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol?
The canonical SMILES for 2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol is COc1ccc(-c2nc(CN3CCCCC3)ccc2O)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol?
The InChIKey is GVHFIOFXWMUXGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-22-16-8-5-14(6-9-16)18-17(21)10-7-15(19-18)13-20-11-3-2-4-12-20/h5-10,21H,2-4,11-13H2,1H3.
What are the key properties of 2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol?
2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol has a molecular weight of 298.39 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-6-(piperidin-1-ylmethyl)pyridin-3-ol is sourced from PubChem (CID 612056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).