2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide

C18H16N2O2 — CID 3237282

IUPAC2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide
SMILESCc1nc(C)c(C(=O)Nc2ccccc2-c2ccccc2)o1
InChIInChI=1S/C18H16N2O2/c1-12-17(22-13(2)19-12)18(21)20-16-11-7-6-10-15(16)14-8-4-3-5-9-14/h3-11H,1-2H3,(H,20,21)
InChIKeyCQLQTMCWHVZRCO-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.21
Rot. Bonds3

About 2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide

2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide (PubChem CID 3237282) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide
PubChem CID3237282
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide
SMILESCc1nc(C)c(C(=O)Nc2ccccc2-c2ccccc2)o1
InChIInChI=1S/C18H16N2O2/c1-12-17(22-13(2)19-12)18(21)20-16-11-7-6-10-15(16)14-8-4-3-5-9-14/h3-11H,1-2H3,(H,20,21)
InChIKeyCQLQTMCWHVZRCO-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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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide?
The IUPAC name of 2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide (CID 3237282) is 2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide.
What is the SMILES notation for 2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide?
The canonical SMILES for 2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide is Cc1nc(C)c(C(=O)Nc2ccccc2-c2ccccc2)o1.
What is the InChIKey of 2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide?
The InChIKey is CQLQTMCWHVZRCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-12-17(22-13(2)19-12)18(21)20-16-11-7-6-10-15(16)14-8-4-3-5-9-14/h3-11H,1-2H3,(H,20,21).
What are the key properties of 2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide?
2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-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 2,4-dimethyl-N-(2-phenylphenyl)-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 3237282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).