[1,3]oxazolo[4,5-b]pyridin-2-ylmethanol

C7H6N2O2 — CID 83383622

IUPAC[1,3]oxazolo[4,5-b]pyridin-2-ylmethanol
SMILESOCc1nc2ncccc2o1
InChIInChI=1S/C7H6N2O2/c10-4-6-9-7-5(11-6)2-1-3-8-7/h1-3,10H,4H2
InChIKeyNTVQDQNFNGZABP-UHFFFAOYSA-N
MW150.14 g/mol
LogP0.72
Rot. Bonds1

About [1,3]oxazolo[4,5-b]pyridin-2-ylmethanol

[1,3]oxazolo[4,5-b]pyridin-2-ylmethanol (PubChem CID 83383622) has the molecular formula C7H6N2O2 and a molecular weight of 150.14 g/mol. Its IUPAC name is [1,3]oxazolo[4,5-b]pyridin-2-ylmethanol.

Molecular Properties

Compound Name[1,3]oxazolo[4,5-b]pyridin-2-ylmethanol
PubChem CID83383622
Molecular FormulaC7H6N2O2
Molecular Weight150.14 g/mol
Exact Mass150.04
IUPAC Name[1,3]oxazolo[4,5-b]pyridin-2-ylmethanol
SMILESOCc1nc2ncccc2o1
InChIInChI=1S/C7H6N2O2/c10-4-6-9-7-5(11-6)2-1-3-8-7/h1-3,10H,4H2
InChIKeyNTVQDQNFNGZABP-UHFFFAOYSA-N
XLogP0.72
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.14
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1,3]oxazolo[4,5-b]pyridin-2-ylmethanol?
The IUPAC name of [1,3]oxazolo[4,5-b]pyridin-2-ylmethanol (CID 83383622) is [1,3]oxazolo[4,5-b]pyridin-2-ylmethanol.
What is the SMILES notation for [1,3]oxazolo[4,5-b]pyridin-2-ylmethanol?
The canonical SMILES for [1,3]oxazolo[4,5-b]pyridin-2-ylmethanol is OCc1nc2ncccc2o1.
What is the InChIKey of [1,3]oxazolo[4,5-b]pyridin-2-ylmethanol?
The InChIKey is NTVQDQNFNGZABP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O2/c10-4-6-9-7-5(11-6)2-1-3-8-7/h1-3,10H,4H2.
What are the key properties of [1,3]oxazolo[4,5-b]pyridin-2-ylmethanol?
[1,3]oxazolo[4,5-b]pyridin-2-ylmethanol has a molecular weight of 150.14 g/mol, XLogP of 0.72, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1,3]oxazolo[4,5-b]pyridin-2-ylmethanol is sourced from PubChem (CID 83383622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).