5-methyloxadiazolo[5,4-b]pyridine

C6H5N3O — CID 89391891

IUPAC5-methyloxadiazolo[5,4-b]pyridine
SMILESCc1ccc2nnoc2n1
InChIInChI=1S/C6H5N3O/c1-4-2-3-5-6(7-4)10-9-8-5/h2-3H,1H3
InChIKeyXIGVNMAGNZFLJG-UHFFFAOYSA-N
MW135.13 g/mol
LogP0.93
Rot. Bonds

About 5-methyloxadiazolo[5,4-b]pyridine

5-methyloxadiazolo[5,4-b]pyridine (PubChem CID 89391891) has the molecular formula C6H5N3O and a molecular weight of 135.13 g/mol. Its IUPAC name is 5-methyloxadiazolo[5,4-b]pyridine.

Molecular Properties

Compound Name5-methyloxadiazolo[5,4-b]pyridine
PubChem CID89391891
Molecular FormulaC6H5N3O
Molecular Weight135.13 g/mol
Exact Mass135.04
IUPAC Name5-methyloxadiazolo[5,4-b]pyridine
SMILESCc1ccc2nnoc2n1
InChIInChI=1S/C6H5N3O/c1-4-2-3-5-6(7-4)10-9-8-5/h2-3H,1H3
InChIKeyXIGVNMAGNZFLJG-UHFFFAOYSA-N
XLogP0.93
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.13
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(1,2,3)Oxadiazolo(5,4-b)pyridine
CID 56972355
2,5-Dimethyl-[1,3]oxazolo[5,4-b]pyridine
CID 58047196
Oxadiazolo[5,4-b]pyridine-5-carboxylic acid
CID 67350430
7-Methyloxadiazolo[5,4-b]pyridine
CID 68274694
5-Methyl-2-propyl-[1,3]oxazolo[5,4-b]pyridine
CID 82337940
5-Tert-butyloxadiazolo[5,4-b]pyridine
CID 90328675
Azane;2,5-dimethyl-[1,3]oxazolo[5,4-b]pyridine
CID 118387720
5-Ethyloxadiazolo[5,4-b]pyridine
CID 118549902
5-Propan-2-yloxadiazolo[5,4-b]pyridine
CID 130232068
(2,5-Dioxopyrrolidin-1-yl) oxadiazolo[5,4-b]pyridine-5-carboxylate
CID 140072322
5,6-Diphenyloxadiazolo[5,4-b]pyridine
CID 140681171
6,7-Dimethyl-5-phenyloxadiazolo[5,4-b]pyridine
CID 140681174

Frequently Asked Questions

What is the IUPAC name of 5-methyloxadiazolo[5,4-b]pyridine?
The IUPAC name of 5-methyloxadiazolo[5,4-b]pyridine (CID 89391891) is 5-methyloxadiazolo[5,4-b]pyridine.
What is the SMILES notation for 5-methyloxadiazolo[5,4-b]pyridine?
The canonical SMILES for 5-methyloxadiazolo[5,4-b]pyridine is Cc1ccc2nnoc2n1.
What is the InChIKey of 5-methyloxadiazolo[5,4-b]pyridine?
The InChIKey is XIGVNMAGNZFLJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N3O/c1-4-2-3-5-6(7-4)10-9-8-5/h2-3H,1H3.
What are the key properties of 5-methyloxadiazolo[5,4-b]pyridine?
5-methyloxadiazolo[5,4-b]pyridine has a molecular weight of 135.13 g/mol, XLogP of 0.93, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyloxadiazolo[5,4-b]pyridine is sourced from PubChem (CID 89391891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).