2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol

C11H15NO3 — CID 19930227

IUPAC2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol
SMILESOCc1cccc(C2CC(O)CCO2)n1
InChIInChI=1S/C11H15NO3/c13-7-8-2-1-3-10(12-8)11-6-9(14)4-5-15-11/h1-3,9,11,13-14H,4-7H2
InChIKeyUQTAMJPMGORQRA-UHFFFAOYSA-N
MW209.24 g/mol
LogP0.79
Rot. Bonds2

About 2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol

2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol (PubChem CID 19930227) has the molecular formula C11H15NO3 and a molecular weight of 209.24 g/mol. Its IUPAC name is 2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol.

Molecular Properties

Compound Name2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol
PubChem CID19930227
Molecular FormulaC11H15NO3
Molecular Weight209.24 g/mol
Exact Mass209.11
IUPAC Name2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol
SMILESOCc1cccc(C2CC(O)CCO2)n1
InChIInChI=1S/C11H15NO3/c13-7-8-2-1-3-10(12-8)11-6-9(14)4-5-15-11/h1-3,9,11,13-14H,4-7H2
InChIKeyUQTAMJPMGORQRA-UHFFFAOYSA-N
XLogP0.79
TPSA62.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.24
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1,2-Bis(6-methyl-2-pyridyl)ethanediol
CID 96212
6-Methyl-2-pyridylmethanol
CID 70736
2,6-Pyridinedimethanol
CID 70957
2,6-Bis(4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl)pyridine
CID 343127
1-(6-(1-Hydroxy-ethyl)-pyridin-2-YL)-ethanol
CID 4363597
(Z)-6-[6-(1-hydroxyhexyl)-2-pyridinyl]hex-5-enoic acid
CID 44318466
(E)-1,2-bis(6-methyl-2-pyridinyl)ethene-1,2-diol
CID 135502910
1-(6-Methylpyridin-2-yl)ethanol
CID 353138
(6-Methylpyridin-2-yl)methyl acetate
CID 291137
Dimethyl pyridine-2,6-bis(carbimidate)
CID 13047094
Hydroxymuscopyridine A
CID 184938
Hydroxymuscopyridine B
CID 184939

Frequently Asked Questions

What is the IUPAC name of 2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol?
The IUPAC name of 2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol (CID 19930227) is 2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol.
What is the SMILES notation for 2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol?
The canonical SMILES for 2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol is OCc1cccc(C2CC(O)CCO2)n1.
What is the InChIKey of 2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol?
The InChIKey is UQTAMJPMGORQRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c13-7-8-2-1-3-10(12-8)11-6-9(14)4-5-15-11/h1-3,9,11,13-14H,4-7H2.
What are the key properties of 2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol?
2-[6-(hydroxymethyl)-2-pyridinyl]oxan-4-ol has a molecular weight of 209.24 g/mol, XLogP of 0.79, 2 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]oxan-4-ol is sourced from PubChem (CID 19930227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).