[6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol

C13H20N2O — CID 61256877

IUPAC[6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol
SMILESCCC1CCCN(c2ccc(CO)cn2)C1
InChIInChI=1S/C13H20N2O/c1-2-11-4-3-7-15(9-11)13-6-5-12(10-16)8-14-13/h5-6,8,11,16H,2-4,7,9-10H2,1H3
InChIKeyJFFWRCVHXWFMND-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.20
Rot. Bonds3

About [6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol

[6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol (PubChem CID 61256877) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is [6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol
PubChem CID61256877
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name[6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol
SMILESCCC1CCCN(c2ccc(CO)cn2)C1
InChIInChI=1S/C13H20N2O/c1-2-11-4-3-7-15(9-11)13-6-5-12(10-16)8-14-13/h5-6,8,11,16H,2-4,7,9-10H2,1H3
InChIKeyJFFWRCVHXWFMND-UHFFFAOYSA-N
XLogP2.20
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 ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol?
The IUPAC name of [6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol (CID 61256877) is [6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol.
What is the SMILES notation for [6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol?
The canonical SMILES for [6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol is CCC1CCCN(c2ccc(CO)cn2)C1.
What is the InChIKey of [6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol?
The InChIKey is JFFWRCVHXWFMND-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-2-11-4-3-7-15(9-11)13-6-5-12(10-16)8-14-13/h5-6,8,11,16H,2-4,7,9-10H2,1H3.
What are the key properties of [6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol?
[6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol has a molecular weight of 220.32 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol is sourced from PubChem (CID 61256877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).