2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol

C8H11NO3 — CID 62240901

IUPAC2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol
SMILESOCCOc1cccc(CO)n1
InChIInChI=1S/C8H11NO3/c10-4-5-12-8-3-1-2-7(6-11)9-8/h1-3,10-11H,4-6H2
InChIKeyPWDNNDCJUNOLIU-UHFFFAOYSA-N
MW169.18 g/mol
LogP-0.05
Rot. Bonds4

About 2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol

2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol (PubChem CID 62240901) has the molecular formula C8H11NO3 and a molecular weight of 169.18 g/mol. Its IUPAC name is 2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol.

Molecular Properties

Compound Name2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol
PubChem CID62240901
Molecular FormulaC8H11NO3
Molecular Weight169.18 g/mol
Exact Mass169.07
IUPAC Name2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol
SMILESOCCOc1cccc(CO)n1
InChIInChI=1S/C8H11NO3/c10-4-5-12-8-3-1-2-7(6-11)9-8/h1-3,10-11H,4-6H2
InChIKeyPWDNNDCJUNOLIU-UHFFFAOYSA-N
XLogP-0.05
TPSA62.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol?
The IUPAC name of 2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol (CID 62240901) is 2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol.
What is the SMILES notation for 2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol?
The canonical SMILES for 2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol is OCCOc1cccc(CO)n1.
What is the InChIKey of 2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol?
The InChIKey is PWDNNDCJUNOLIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3/c10-4-5-12-8-3-1-2-7(6-11)9-8/h1-3,10-11H,4-6H2.
What are the key properties of 2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol?
2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol has a molecular weight of 169.18 g/mol, XLogP of -0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(hydroxymethyl)-2-pyridinyl]oxy]ethanol is sourced from PubChem (CID 62240901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).