5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole

C15H12N2O — CID 44546226

IUPAC5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole
SMILESCc1cccc(-c2cc(-c3cccnc3)no2)c1
InChIInChI=1S/C15H12N2O/c1-11-4-2-5-12(8-11)15-9-14(17-18-15)13-6-3-7-16-10-13/h2-10H,1H3
InChIKeyIYZYORWOMUSSAL-UHFFFAOYSA-N
MW236.27 g/mol
LogP3.71
Rot. Bonds2

About 5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole

5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole (PubChem CID 44546226) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole.

Molecular Properties

Compound Name5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole
PubChem CID44546226
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole
SMILESCc1cccc(-c2cc(-c3cccnc3)no2)c1
InChIInChI=1S/C15H12N2O/c1-11-4-2-5-12(8-11)15-9-14(17-18-15)13-6-3-7-16-10-13/h2-10H,1H3
InChIKeyIYZYORWOMUSSAL-UHFFFAOYSA-N
XLogP3.71
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,5-dipyridin-3-yl-1,2-oxazole
CID 14593332
1-[3-(3-pyridin-3-yl-1,2-oxazol-5-yl)phenyl]ethanone
CID 44546286
3-(4-tert-butylphenyl)-5-pyridin-3-yl-1,2-oxazole
CID 99964771
methylidenephosphane;3-(3-methylphenyl)pyridine
CID 144875841
formic acid;3-methyl-5-(3-methylphenyl)-1,2-oxazole
CID 176993673
ethylphosphane;3-(3-methylphenyl)pyridine
CID 144632052
ethane;5-ethyl-3-pyridin-3-yl-1,2-oxazole
CID 143675921
1-(3-pyridin-3-yl-1,2-oxazol-5-yl)ethanol
CID 44605540
methane;5-methyl-3-(3-methylphenyl)-1,2-oxazole
CID 161177844
methyl-diphenyl-(3-pyridin-3-yl-1,2-oxazol-5-yl)silane
CID 10593425
5-(chloromethyl)-3-pyridin-3-yl-1,2-oxazole;hydrochloride
CID 53398877
5-phenyl-3-pyridin-4-yl-1,2-oxazole
CID 5112426

Frequently Asked Questions

What is the IUPAC name of 5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole?
The IUPAC name of 5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole (CID 44546226) is 5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole.
What is the SMILES notation for 5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole?
The canonical SMILES for 5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole is Cc1cccc(-c2cc(-c3cccnc3)no2)c1.
What is the InChIKey of 5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole?
The InChIKey is IYZYORWOMUSSAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c1-11-4-2-5-12(8-11)15-9-14(17-18-15)13-6-3-7-16-10-13/h2-10H,1H3.
What are the key properties of 5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole?
5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole has a molecular weight of 236.27 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methylphenyl)-3-pyridin-3-yl-1,2-oxazole is sourced from PubChem (CID 44546226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).