6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole

C15H13NO2 — CID 135041622

IUPAC6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole
SMILESCOc1cc(C)c2nc(-c3ccccc3)oc2c1
InChIInChI=1S/C15H13NO2/c1-10-8-12(17-2)9-13-14(10)16-15(18-13)11-6-4-3-5-7-11/h3-9H,1-2H3
InChIKeyOVLAEVBHMXFIAU-UHFFFAOYSA-N
MW239.27 g/mol
LogP3.81
Rot. Bonds2

About 6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole

6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole (PubChem CID 135041622) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is 6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole.

Molecular Properties

Compound Name6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole
PubChem CID135041622
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Name6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole
SMILESCOc1cc(C)c2nc(-c3ccccc3)oc2c1
InChIInChI=1S/C15H13NO2/c1-10-8-12(17-2)9-13-14(10)16-15(18-13)11-6-4-3-5-7-11/h3-9H,1-2H3
InChIKeyOVLAEVBHMXFIAU-UHFFFAOYSA-N
XLogP3.81
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole 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

4-methyl-2-[4-(3-phenylphenyl)phenyl]-1,3-benzoxazole
CID 163632646
4,6-dimethyl-2-(4-methylphenyl)-1,3-benzoxazole
CID 82231763
2-(4-hydroxyphenyl)-4-methyl-1,3-benzoxazol-6-ol
CID 135830958
7-bromo-4,6-dimethyl-2-phenyl-1,3-benzoxazole
CID 82234163
4-[(2,4-dimethoxyphenyl)methoxy]-2-phenyl-1,3-benzoxazole
CID 102167898
6-methoxy-2-(3-methylphenyl)-1,3-benzoxazole
CID 135041335
(2-phenyl-1,3-benzoxazol-6-yl) acetate
CID 15662262
2-(4-chlorophenyl)-4-methyl-1,3-benzoxazole-6-carboxylic acid
CID 172815570
(5-methoxy-2-phenyl-1,3-benzoxazol-7-yl)methanol
CID 76851601
5-methoxy-1,2-dimethyl-3-phenylbenzene
CID 67554747
1,1'-biphenyl;1,4-dimethoxy-2-methylbenzene
CID 159369138
5-iodo-6-methoxy-2-phenyl-1,3-benzoxazole
CID 135041738

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole?
The IUPAC name of 6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole (CID 135041622) is 6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole.
What is the SMILES notation for 6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole?
The canonical SMILES for 6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole is COc1cc(C)c2nc(-c3ccccc3)oc2c1.
What is the InChIKey of 6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole?
The InChIKey is OVLAEVBHMXFIAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2/c1-10-8-12(17-2)9-13-14(10)16-15(18-13)11-6-4-3-5-7-11/h3-9H,1-2H3.
What are the key properties of 6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole?
6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole has a molecular weight of 239.27 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-methyl-2-phenyl-1,3-benzoxazole is sourced from PubChem (CID 135041622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).