3-methyl-[1,2]oxazolo[4,5-c]pyridine

C7H6N2O — CID 5325773

IUPAC3-methyl-[1,2]oxazolo[4,5-c]pyridine
SMILESCc1noc2ccncc12
InChIInChI=1S/C7H6N2O/c1-5-6-4-8-3-2-7(6)10-9-5/h2-4H,1H3
InChIKeyDCBAVYBQNFMNNH-UHFFFAOYSA-N
MW134.14 g/mol
LogP1.53
Rot. Bonds

About 3-methyl-[1,2]oxazolo[4,5-c]pyridine

3-methyl-[1,2]oxazolo[4,5-c]pyridine (PubChem CID 5325773) has the molecular formula C7H6N2O and a molecular weight of 134.14 g/mol. Its IUPAC name is 3-methyl-[1,2]oxazolo[4,5-c]pyridine.

Molecular Properties

Compound Name3-methyl-[1,2]oxazolo[4,5-c]pyridine
PubChem CID5325773
Molecular FormulaC7H6N2O
Molecular Weight134.14 g/mol
Exact Mass134.05
IUPAC Name3-methyl-[1,2]oxazolo[4,5-c]pyridine
SMILESCc1noc2ccncc12
InChIInChI=1S/C7H6N2O/c1-5-6-4-8-3-2-7(6)10-9-5/h2-4H,1H3
InChIKeyDCBAVYBQNFMNNH-UHFFFAOYSA-N
XLogP1.53
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-[1,2]oxazolo[4,5-c]pyridine?
The IUPAC name of 3-methyl-[1,2]oxazolo[4,5-c]pyridine (CID 5325773) is 3-methyl-[1,2]oxazolo[4,5-c]pyridine.
What is the SMILES notation for 3-methyl-[1,2]oxazolo[4,5-c]pyridine?
The canonical SMILES for 3-methyl-[1,2]oxazolo[4,5-c]pyridine is Cc1noc2ccncc12.
What is the InChIKey of 3-methyl-[1,2]oxazolo[4,5-c]pyridine?
The InChIKey is DCBAVYBQNFMNNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O/c1-5-6-4-8-3-2-7(6)10-9-5/h2-4H,1H3.
What are the key properties of 3-methyl-[1,2]oxazolo[4,5-c]pyridine?
3-methyl-[1,2]oxazolo[4,5-c]pyridine has a molecular weight of 134.14 g/mol, XLogP of 1.53, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-[1,2]oxazolo[4,5-c]pyridine is sourced from PubChem (CID 5325773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).