2-ethenyl-6-(hydroxymethyl)pyridin-3-ol

C8H9NO2 — CID 118097163

IUPAC2-ethenyl-6-(hydroxymethyl)pyridin-3-ol
SMILESC=Cc1nc(CO)ccc1O
InChIInChI=1S/C8H9NO2/c1-2-7-8(11)4-3-6(5-10)9-7/h2-4,10-11H,1,5H2
InChIKeyWXVRRMACIASTKT-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.92
Rot. Bonds2

About 2-ethenyl-6-(hydroxymethyl)pyridin-3-ol

2-ethenyl-6-(hydroxymethyl)pyridin-3-ol (PubChem CID 118097163) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is 2-ethenyl-6-(hydroxymethyl)pyridin-3-ol.

Molecular Properties

Compound Name2-ethenyl-6-(hydroxymethyl)pyridin-3-ol
PubChem CID118097163
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC Name2-ethenyl-6-(hydroxymethyl)pyridin-3-ol
SMILESC=Cc1nc(CO)ccc1O
InChIInChI=1S/C8H9NO2/c1-2-7-8(11)4-3-6(5-10)9-7/h2-4,10-11H,1,5H2
InChIKeyWXVRRMACIASTKT-UHFFFAOYSA-N
XLogP0.92
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-6-(hydroxymethyl)pyridin-3-ol?
The IUPAC name of 2-ethenyl-6-(hydroxymethyl)pyridin-3-ol (CID 118097163) is 2-ethenyl-6-(hydroxymethyl)pyridin-3-ol.
What is the SMILES notation for 2-ethenyl-6-(hydroxymethyl)pyridin-3-ol?
The canonical SMILES for 2-ethenyl-6-(hydroxymethyl)pyridin-3-ol is C=Cc1nc(CO)ccc1O.
What is the InChIKey of 2-ethenyl-6-(hydroxymethyl)pyridin-3-ol?
The InChIKey is WXVRRMACIASTKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2/c1-2-7-8(11)4-3-6(5-10)9-7/h2-4,10-11H,1,5H2.
What are the key properties of 2-ethenyl-6-(hydroxymethyl)pyridin-3-ol?
2-ethenyl-6-(hydroxymethyl)pyridin-3-ol has a molecular weight of 151.16 g/mol, XLogP of 0.92, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-6-(hydroxymethyl)pyridin-3-ol is sourced from PubChem (CID 118097163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).