N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide

C18H16N2O2 — CID 110649553

IUPACN-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide
SMILESCc1ccc(-c2oncc2C(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C18H16N2O2/c1-12-7-9-14(10-8-12)17-15(11-19-22-17)18(21)20-16-6-4-3-5-13(16)2/h3-11H,1-2H3,(H,20,21)
InChIKeyVPLZKFCFWYXFJM-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.21
Rot. Bonds3

About N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide

N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide (PubChem CID 110649553) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide
PubChem CID110649553
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC NameN-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide
SMILESCc1ccc(-c2oncc2C(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C18H16N2O2/c1-12-7-9-14(10-8-12)17-15(11-19-22-17)18(21)20-16-6-4-3-5-13(16)2/h3-11H,1-2H3,(H,20,21)
InChIKeyVPLZKFCFWYXFJM-UHFFFAOYSA-N
XLogP4.21
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-N-(2-methylphenyl)-1,2-oxazole-4-carboxamide
CID 850304
N-(2-bromophenyl)-5-phenyl-1,2-oxazole-4-carboxamide
CID 110409938
N-(2-chlorophenyl)-5-(4-methoxyphenyl)-1,2-oxazole-4-carboxamide
CID 110649994
5-(4-methylphenyl)-N-(2-phenylpropyl)-1,2-oxazole-4-carboxamide
CID 59170277
N-(2,4-dimethylphenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 71393848
2,5-dimethyl-N-(2-methylphenyl)benzamide
CID 925354
ethane;4-methyl-N-(2-methylphenyl)benzamide
CID 145337643
N-methyl-5-(4-methylphenyl)-N-phenyl-1,2-oxazole-4-carboxamide
CID 110649624
N-(2-ethylphenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 850891
N-[1-(4-fluorophenyl)ethyl]-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide
CID 59170223
N-(3-acetamidophenyl)-5-(4-fluorophenyl)-1,2-oxazole-4-carboxamide
CID 110650555
N-[2-(4-chlorophenyl)ethyl]-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide
CID 59170194

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide?
The IUPAC name of N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide (CID 110649553) is N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide is Cc1ccc(-c2oncc2C(=O)Nc2ccccc2C)cc1.
What is the InChIKey of N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide?
The InChIKey is VPLZKFCFWYXFJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-12-7-9-14(10-8-12)17-15(11-19-22-17)18(21)20-16-6-4-3-5-13(16)2/h3-11H,1-2H3,(H,20,21).
What are the key properties of N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide?
N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 110649553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).