[6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol

C8H11NO3 — CID 119094764

IUPAC[6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol
SMILESCOc1ccc(CO)nc1CO
InChIInChI=1S/C8H11NO3/c1-12-8-3-2-6(4-10)9-7(8)5-11/h2-3,10-11H,4-5H2,1H3
InChIKeyNOEUKXPNJSYPNR-UHFFFAOYSA-N
MW169.18 g/mol
LogP0.07
Rot. Bonds3

About [6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol

[6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol (PubChem CID 119094764) has the molecular formula C8H11NO3 and a molecular weight of 169.18 g/mol. Its IUPAC name is [6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol
PubChem CID119094764
Molecular FormulaC8H11NO3
Molecular Weight169.18 g/mol
Exact Mass169.07
IUPAC Name[6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol
SMILESCOc1ccc(CO)nc1CO
InChIInChI=1S/C8H11NO3/c1-12-8-3-2-6(4-10)9-7(8)5-11/h2-3,10-11H,4-5H2,1H3
InChIKeyNOEUKXPNJSYPNR-UHFFFAOYSA-N
XLogP0.07
TPSA62.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol?
The IUPAC name of [6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol (CID 119094764) is [6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol.
What is the SMILES notation for [6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol?
The canonical SMILES for [6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol is COc1ccc(CO)nc1CO.
What is the InChIKey of [6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol?
The InChIKey is NOEUKXPNJSYPNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3/c1-12-8-3-2-6(4-10)9-7(8)5-11/h2-3,10-11H,4-5H2,1H3.
What are the key properties of [6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol?
[6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol has a molecular weight of 169.18 g/mol, XLogP of 0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(hydroxymethyl)-5-methoxy-2-pyridinyl]methanol is sourced from PubChem (CID 119094764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).