1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol

C13H20N2O — CID 110540631

IUPAC1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol
SMILESCCN1CCC(O)C(Cc2ccccn2)C1
InChIInChI=1S/C13H20N2O/c1-2-15-8-6-13(16)11(10-15)9-12-5-3-4-7-14-12/h3-5,7,11,13,16H,2,6,8-10H2,1H3
InChIKeyKORMEDSDYVROQC-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.33
Rot. Bonds3

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

1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol (PubChem CID 110540631) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol.

Molecular Properties

Compound Name1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol
PubChem CID110540631
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol
SMILESCCN1CCC(O)C(Cc2ccccn2)C1
InChIInChI=1S/C13H20N2O/c1-2-15-8-6-13(16)11(10-15)9-12-5-3-4-7-14-12/h3-5,7,11,13,16H,2,6,8-10H2,1H3
InChIKeyKORMEDSDYVROQC-UHFFFAOYSA-N
XLogP1.33
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol?
The IUPAC name of 1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol (CID 110540631) is 1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol.
What is the SMILES notation for 1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol?
The canonical SMILES for 1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol is CCN1CCC(O)C(Cc2ccccn2)C1.
What is the InChIKey of 1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol?
The InChIKey is KORMEDSDYVROQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-2-15-8-6-13(16)11(10-15)9-12-5-3-4-7-14-12/h3-5,7,11,13,16H,2,6,8-10H2,1H3.
What are the key properties of 1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol?
1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol has a molecular weight of 220.32 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(pyridin-2-ylmethyl)piperidin-4-ol is sourced from PubChem (CID 110540631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).