2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide

C24H20N2O3 — CID 100500293

IUPAC2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide
SMILESCOc1cccc(-c2cnc(-c3ccccc3C(=O)Nc3ccccc3C)o2)c1
InChIInChI=1S/C24H20N2O3/c1-16-8-3-6-13-21(16)26-23(27)19-11-4-5-12-20(19)24-25-15-22(29-24)17-9-7-10-18(14-17)28-2/h3-15H,1-2H3,(H,26,27)
InChIKeyBWGADCQOMPGYOV-UHFFFAOYSA-N
MW384.44 g/mol
LogP5.58
Rot. Bonds5

About 2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide

2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide (PubChem CID 100500293) has the molecular formula C24H20N2O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is 2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide.

Molecular Properties

Compound Name2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide
PubChem CID100500293
Molecular FormulaC24H20N2O3
Molecular Weight384.44 g/mol
Exact Mass384.15
IUPAC Name2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide
SMILESCOc1cccc(-c2cnc(-c3ccccc3C(=O)Nc3ccccc3C)o2)c1
InChIInChI=1S/C24H20N2O3/c1-16-8-3-6-13-21(16)26-23(27)19-11-4-5-12-20(19)24-25-15-22(29-24)17-9-7-10-18(14-17)28-2/h3-15H,1-2H3,(H,26,27)
InChIKeyBWGADCQOMPGYOV-UHFFFAOYSA-N
XLogP5.58
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.44
LogP ≤ 55.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide?
The IUPAC name of 2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide (CID 100500293) is 2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide.
What is the SMILES notation for 2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide?
The canonical SMILES for 2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide is COc1cccc(-c2cnc(-c3ccccc3C(=O)Nc3ccccc3C)o2)c1.
What is the InChIKey of 2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide?
The InChIKey is BWGADCQOMPGYOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O3/c1-16-8-3-6-13-21(16)26-23(27)19-11-4-5-12-20(19)24-25-15-22(29-24)17-9-7-10-18(14-17)28-2/h3-15H,1-2H3,(H,26,27).
What are the key properties of 2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide?
2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide has a molecular weight of 384.44 g/mol, XLogP of 5.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)benzamide is sourced from PubChem (CID 100500293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).