N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide

C18H16N2O2 — CID 973857

IUPACN-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(-c2ccccc2)on1
InChIInChI=1S/C18H16N2O2/c1-2-13-8-6-7-11-15(13)19-18(21)16-12-17(22-20-16)14-9-4-3-5-10-14/h3-12H,2H2,1H3,(H,19,21)
InChIKeyRXHMNYZAIKMIJI-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.16
Rot. Bonds4

About N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide

N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide (PubChem CID 973857) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
PubChem CID973857
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC NameN-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(-c2ccccc2)on1
InChIInChI=1S/C18H16N2O2/c1-2-13-8-6-7-11-15(13)19-18(21)16-12-17(22-20-16)14-9-4-3-5-10-14/h3-12H,2H2,1H3,(H,19,21)
InChIKeyRXHMNYZAIKMIJI-UHFFFAOYSA-N
XLogP4.16
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide (CID 973857) is N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide is CCc1ccccc1NC(=O)c1cc(-c2ccccc2)on1.
What is the InChIKey of N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide?
The InChIKey is RXHMNYZAIKMIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-2-13-8-6-7-11-15(13)19-18(21)16-12-17(22-20-16)14-9-4-3-5-10-14/h3-12H,2H2,1H3,(H,19,21).
What are the key properties of N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide?
N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide has a molecular weight of 292.34 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 973857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).