[3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol

C15H24N2O2 — CID 72912581

IUPAC[3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol
SMILESCOCCC1(CO)CCCN(Cc2ccncc2)C1
InChIInChI=1S/C15H24N2O2/c1-19-10-6-15(13-18)5-2-9-17(12-15)11-14-3-7-16-8-4-14/h3-4,7-8,18H,2,5-6,9-13H2,1H3
InChIKeyAXABINBRAPAUBU-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.69
Rot. Bonds6

About [3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol

[3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol (PubChem CID 72912581) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is [3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol
PubChem CID72912581
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name[3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol
SMILESCOCCC1(CO)CCCN(Cc2ccncc2)C1
InChIInChI=1S/C15H24N2O2/c1-19-10-6-15(13-18)5-2-9-17(12-15)11-14-3-7-16-8-4-14/h3-4,7-8,18H,2,5-6,9-13H2,1H3
InChIKeyAXABINBRAPAUBU-UHFFFAOYSA-N
XLogP1.69
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol?
The IUPAC name of [3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol (CID 72912581) is [3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol.
What is the SMILES notation for [3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol?
The canonical SMILES for [3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol is COCCC1(CO)CCCN(Cc2ccncc2)C1.
What is the InChIKey of [3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol?
The InChIKey is AXABINBRAPAUBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-19-10-6-15(13-18)5-2-9-17(12-15)11-14-3-7-16-8-4-14/h3-4,7-8,18H,2,5-6,9-13H2,1H3.
What are the key properties of [3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol?
[3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol has a molecular weight of 264.37 g/mol, XLogP of 1.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methoxyethyl)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methanol is sourced from PubChem (CID 72912581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).