5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine

C14H12N2O2 — CID 117000974

IUPAC5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine
SMILESCOc1ccccc1-c1ccc2oc(C)nc2n1
InChIInChI=1S/C14H12N2O2/c1-9-15-14-13(18-9)8-7-11(16-14)10-5-3-4-6-12(10)17-2/h3-8H,1-2H3
InChIKeyZQHLXSURPLGXGO-UHFFFAOYSA-N
MW240.26 g/mol
LogP3.21
Rot. Bonds2

About 5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine

5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine (PubChem CID 117000974) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine.

Molecular Properties

Compound Name5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine
PubChem CID117000974
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC Name5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine
SMILESCOc1ccccc1-c1ccc2oc(C)nc2n1
InChIInChI=1S/C14H12N2O2/c1-9-15-14-13(18-9)8-7-11(16-14)10-5-3-4-6-12(10)17-2/h3-8H,1-2H3
InChIKeyZQHLXSURPLGXGO-UHFFFAOYSA-N
XLogP3.21
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 10691911
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6-(2-methoxyphenyl)-2-methylpyrido[3,2-d]pyrimidin-4-amine
CID 163213178
2-(2-methoxyphenyl)-1,10-phenanthroline;hydrochloride
CID 140537308
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CID 39818676
6-(2-methoxyphenyl)pyridine-2,3-dicarboxylic acid
CID 10923717
[6-(2-methoxyphenyl)-2-pyridinyl]methanol
CID 24730094
5-(1-benzofuran-2-yl)-3-(2-methoxyphenyl)-1,2-oxazole
CID 99964755
2-methoxy-6-(2-methoxyphenyl)pyrazine
CID 135043154
1-[4-(2-methoxyphenyl)-1,2-oxazol-5-yl]ethanamine
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CID 19586953

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine?
The IUPAC name of 5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine (CID 117000974) is 5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine.
What is the SMILES notation for 5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine?
The canonical SMILES for 5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine is COc1ccccc1-c1ccc2oc(C)nc2n1.
What is the InChIKey of 5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine?
The InChIKey is ZQHLXSURPLGXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2/c1-9-15-14-13(18-9)8-7-11(16-14)10-5-3-4-6-12(10)17-2/h3-8H,1-2H3.
What are the key properties of 5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine?
5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine has a molecular weight of 240.26 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)-2-methyl-[1,3]oxazolo[4,5-b]pyridine is sourced from PubChem (CID 117000974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).