2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol

C9H10N2O2 — CID 83384567

IUPAC2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol
SMILESCC(C)(O)c1nc2ncccc2o1
InChIInChI=1S/C9H10N2O2/c1-9(2,12)8-11-7-6(13-8)4-3-5-10-7/h3-5,12H,1-2H3
InChIKeyYUHWNSFWXCYNMT-UHFFFAOYSA-N
MW178.19 g/mol
LogP1.45
Rot. Bonds1

About 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol

2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol (PubChem CID 83384567) has the molecular formula C9H10N2O2 and a molecular weight of 178.19 g/mol. Its IUPAC name is 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol
PubChem CID83384567
Molecular FormulaC9H10N2O2
Molecular Weight178.19 g/mol
Exact Mass178.07
IUPAC Name2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol
SMILESCC(C)(O)c1nc2ncccc2o1
InChIInChI=1S/C9H10N2O2/c1-9(2,12)8-11-7-6(13-8)4-3-5-10-7/h3-5,12H,1-2H3
InChIKeyYUHWNSFWXCYNMT-UHFFFAOYSA-N
XLogP1.45
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol?
The IUPAC name of 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol (CID 83384567) is 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol.
What is the SMILES notation for 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol?
The canonical SMILES for 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol is CC(C)(O)c1nc2ncccc2o1.
What is the InChIKey of 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol?
The InChIKey is YUHWNSFWXCYNMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O2/c1-9(2,12)8-11-7-6(13-8)4-3-5-10-7/h3-5,12H,1-2H3.
What are the key properties of 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol?
2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol has a molecular weight of 178.19 g/mol, XLogP of 1.45, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-([1,3]oxazolo[4,5-b]pyridin-2-yl)propan-2-ol is sourced from PubChem (CID 83384567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).