2-methyl-5-quinolin-3-yl-1,3-oxazole

C13H10N2O — CID 119087022

IUPAC2-methyl-5-quinolin-3-yl-1,3-oxazole
SMILESCc1ncc(-c2cnc3ccccc3c2)o1
InChIInChI=1S/C13H10N2O/c1-9-14-8-13(16-9)11-6-10-4-2-3-5-12(10)15-7-11/h2-8H,1H3
InChIKeyUOPYBJJMRNHPLD-UHFFFAOYSA-N
MW210.24 g/mol
LogP3.20
Rot. Bonds1

About 2-methyl-5-quinolin-3-yl-1,3-oxazole

2-methyl-5-quinolin-3-yl-1,3-oxazole (PubChem CID 119087022) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 2-methyl-5-quinolin-3-yl-1,3-oxazole.

Molecular Properties

Compound Name2-methyl-5-quinolin-3-yl-1,3-oxazole
PubChem CID119087022
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name2-methyl-5-quinolin-3-yl-1,3-oxazole
SMILESCc1ncc(-c2cnc3ccccc3c2)o1
InChIInChI=1S/C13H10N2O/c1-9-14-8-13(16-9)11-6-10-4-2-3-5-12(10)15-7-11/h2-8H,1H3
InChIKeyUOPYBJJMRNHPLD-UHFFFAOYSA-N
XLogP3.20
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-quinolin-3-yl-1,3-oxazole?
The IUPAC name of 2-methyl-5-quinolin-3-yl-1,3-oxazole (CID 119087022) is 2-methyl-5-quinolin-3-yl-1,3-oxazole.
What is the SMILES notation for 2-methyl-5-quinolin-3-yl-1,3-oxazole?
The canonical SMILES for 2-methyl-5-quinolin-3-yl-1,3-oxazole is Cc1ncc(-c2cnc3ccccc3c2)o1.
What is the InChIKey of 2-methyl-5-quinolin-3-yl-1,3-oxazole?
The InChIKey is UOPYBJJMRNHPLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O/c1-9-14-8-13(16-9)11-6-10-4-2-3-5-12(10)15-7-11/h2-8H,1H3.
What are the key properties of 2-methyl-5-quinolin-3-yl-1,3-oxazole?
2-methyl-5-quinolin-3-yl-1,3-oxazole has a molecular weight of 210.24 g/mol, XLogP of 3.20, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-quinolin-3-yl-1,3-oxazole is sourced from PubChem (CID 119087022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).