3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol

C11H15NO2 — CID 137396259

IUPAC3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol
SMILESCC(C)c1ccc(C2(O)COC2)nc1
InChIInChI=1S/C11H15NO2/c1-8(2)9-3-4-10(12-5-9)11(13)6-14-7-11/h3-5,8,13H,6-7H2,1-2H3
InChIKeyQQNNLTTUDRMRCA-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.42
Rot. Bonds2

About 3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol

3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol (PubChem CID 137396259) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol.

Molecular Properties

Compound Name3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol
PubChem CID137396259
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol
SMILESCC(C)c1ccc(C2(O)COC2)nc1
InChIInChI=1S/C11H15NO2/c1-8(2)9-3-4-10(12-5-9)11(13)6-14-7-11/h3-5,8,13H,6-7H2,1-2H3
InChIKeyQQNNLTTUDRMRCA-UHFFFAOYSA-N
XLogP1.42
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-Ethyl-2-pyridineethanol
CID 78894
Alpha,alpha-diphenyl-2-pyridinemethanol
CID 223294
2-Morpholin-4-yl-1-phenyl-1-pyridin-2-ylethanol
CID 5303332
Doxylamine alcohol
CID 86883
alpha,alpha-Diphenyl-2-pyridineethanol
CID 234268
Phenyl(pyridin-2-yl)methanol
CID 315585
(2-Methylphenyl)(2-pyridinyl)methanol
CID 5143164
(1S)-1-phenyl-2-(pyridin-2-yl)ethan-1-ol
CID 11310145
8-Hydroxy-5,6,7,8-tetrahydroquinoline
CID 11815939
alpha-Phenylpyridine-2-ethanol
CID 95435
Pyridine-2,3-dimethanol
CID 12758260
(4-(Pyridin-2-yl)phenyl)methanol
CID 1515239

Frequently Asked Questions

What is the IUPAC name of 3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol?
The IUPAC name of 3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol (CID 137396259) is 3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol.
What is the SMILES notation for 3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol?
The canonical SMILES for 3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol is CC(C)c1ccc(C2(O)COC2)nc1.
What is the InChIKey of 3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol?
The InChIKey is QQNNLTTUDRMRCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-8(2)9-3-4-10(12-5-9)11(13)6-14-7-11/h3-5,8,13H,6-7H2,1-2H3.
What are the key properties of 3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol?
3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol has a molecular weight of 193.25 g/mol, XLogP of 1.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-propan-2-yl-2-pyridinyl)oxetan-3-ol is sourced from PubChem (CID 137396259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).