3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole

C20H15NO — CID 151788347

IUPAC3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole
SMILESCN1C(=C=Cc2ccc3ccccc3c2)Oc2ccccc21
InChIInChI=1S/C20H15NO/c1-21-18-8-4-5-9-19(18)22-20(21)13-11-15-10-12-16-6-2-3-7-17(16)14-15/h2-12,14H,1H3
InChIKeyRWBVOJSMYLRFNF-UHFFFAOYSA-N
MW285.35 g/mol
LogP4.82
Rot. Bonds1

About 3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole

3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole (PubChem CID 151788347) has the molecular formula C20H15NO and a molecular weight of 285.35 g/mol. Its IUPAC name is 3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole.

Molecular Properties

Compound Name3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole
PubChem CID151788347
Molecular FormulaC20H15NO
Molecular Weight285.35 g/mol
Exact Mass285.12
IUPAC Name3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole
SMILESCN1C(=C=Cc2ccc3ccccc3c2)Oc2ccccc21
InChIInChI=1S/C20H15NO/c1-21-18-8-4-5-9-19(18)22-20(21)13-11-15-10-12-16-6-2-3-7-17(16)14-15/h2-12,14H,1H3
InChIKeyRWBVOJSMYLRFNF-UHFFFAOYSA-N
XLogP4.82
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-methyl-2-(2-naphthalen-2-ylethenylidene)-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

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole?
The IUPAC name of 3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole (CID 151788347) is 3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole.
What is the SMILES notation for 3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole?
The canonical SMILES for 3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole is CN1C(=C=Cc2ccc3ccccc3c2)Oc2ccccc21.
What is the InChIKey of 3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole?
The InChIKey is RWBVOJSMYLRFNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO/c1-21-18-8-4-5-9-19(18)22-20(21)13-11-15-10-12-16-6-2-3-7-17(16)14-15/h2-12,14H,1H3.
What are the key properties of 3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole?
3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole has a molecular weight of 285.35 g/mol, XLogP of 4.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-(2-naphthalen-2-ylethenylidene)-1,3-benzoxazole is sourced from PubChem (CID 151788347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).