[1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol

C14H20N2O — CID 165400233

IUPAC[1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol
SMILESC=Cc1ccc(N2CCC(C)(CO)CC2)cn1
InChIInChI=1S/C14H20N2O/c1-3-12-4-5-13(10-15-12)16-8-6-14(2,11-17)7-9-16/h3-5,10,17H,1,6-9,11H2,2H3
InChIKeyHEBMNQIBJNMUMC-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.32
Rot. Bonds3

About [1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol

[1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol (PubChem CID 165400233) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is [1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol
PubChem CID165400233
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name[1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol
SMILESC=Cc1ccc(N2CCC(C)(CO)CC2)cn1
InChIInChI=1S/C14H20N2O/c1-3-12-4-5-13(10-15-12)16-8-6-14(2,11-17)7-9-16/h3-5,10,17H,1,6-9,11H2,2H3
InChIKeyHEBMNQIBJNMUMC-UHFFFAOYSA-N
XLogP2.32
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol?
The IUPAC name of [1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol (CID 165400233) is [1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol.
What is the SMILES notation for [1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol?
The canonical SMILES for [1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol is C=Cc1ccc(N2CCC(C)(CO)CC2)cn1.
What is the InChIKey of [1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol?
The InChIKey is HEBMNQIBJNMUMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-3-12-4-5-13(10-15-12)16-8-6-14(2,11-17)7-9-16/h3-5,10,17H,1,6-9,11H2,2H3.
What are the key properties of [1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol?
[1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol has a molecular weight of 232.33 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-ethenyl-3-pyridinyl)-4-methylpiperidin-4-yl]methanol is sourced from PubChem (CID 165400233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).