N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide

C15H13N3O3 — CID 1093769

IUPACN-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
SMILESCc1ccc(-c2cc(C(=O)Nc3cc(C)on3)no2)cc1
InChIInChI=1S/C15H13N3O3/c1-9-3-5-11(6-4-9)13-8-12(17-21-13)15(19)16-14-7-10(2)20-18-14/h3-8H,1-2H3,(H,16,18,19)
InChIKeyVNURCKZDOIMSLV-UHFFFAOYSA-N
MW283.29 g/mol
LogP3.20
Rot. Bonds3

About N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide

N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide (PubChem CID 1093769) has the molecular formula C15H13N3O3 and a molecular weight of 283.29 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
PubChem CID1093769
Molecular FormulaC15H13N3O3
Molecular Weight283.29 g/mol
Exact Mass283.10
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
SMILESCc1ccc(-c2cc(C(=O)Nc3cc(C)on3)no2)cc1
InChIInChI=1S/C15H13N3O3/c1-9-3-5-11(6-4-9)13-8-12(17-21-13)15(19)16-14-7-10(2)20-18-14/h3-8H,1-2H3,(H,16,18,19)
InChIKeyVNURCKZDOIMSLV-UHFFFAOYSA-N
XLogP3.20
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide (CID 1093769) is N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide is Cc1ccc(-c2cc(C(=O)Nc3cc(C)on3)no2)cc1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
The InChIKey is VNURCKZDOIMSLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O3/c1-9-3-5-11(6-4-9)13-8-12(17-21-13)15(19)16-14-7-10(2)20-18-14/h3-8H,1-2H3,(H,16,18,19).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide?
N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide has a molecular weight of 283.29 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 1093769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).