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

C18H16N2O2 — CID 27285951

IUPACN-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCCc1cccc(NC(=O)c2cc(-c3ccccc3)on2)c1
InChIInChI=1S/C18H16N2O2/c1-2-13-7-6-10-15(11-13)19-18(21)16-12-17(22-20-16)14-8-4-3-5-9-14/h3-12H,2H2,1H3,(H,19,21)
InChIKeySQWBUTZWSCHXOU-UHFFFAOYSA-N
MW292.34 g/mol
LogP4.16
Rot. Bonds4

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

N-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide (PubChem CID 27285951) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is N-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
PubChem CID27285951
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC NameN-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCCc1cccc(NC(=O)c2cc(-c3ccccc3)on2)c1
InChIInChI=1S/C18H16N2O2/c1-2-13-7-6-10-15(11-13)19-18(21)16-12-17(22-20-16)14-8-4-3-5-9-14/h3-12H,2H2,1H3,(H,19,21)
InChIKeySQWBUTZWSCHXOU-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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Related Compounds

N-(3-hydroxyphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 1093722
5-(4-methylphenyl)-N-[3-(pyrazol-1-ylmethyl)phenyl]-1,2-oxazole-3-carboxamide
CID 17022145
N-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide
CID 17011506
dimethyl 5-[(5-phenyl-1,2-oxazole-3-carbonyl)amino]benzene-1,3-dicarboxylate
CID 55445915
N-[4-(furan-2-carbonylamino)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 51327615
1-(3-ethylphenyl)-2-[(5-phenyl-1,2-oxazol-3-yl)methyl]guanidine
CID 111078093
N-(2,6-dimethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 3073010
N-(3,5-dimethoxyphenyl)-5-phenyl-1,2-oxazole-3-carboxamide
CID 27285765
5-phenyl-N-pyridazin-4-yl-1,2-oxazole-3-carboxamide
CID 154876265
5-(4-fluorophenyl)-N-[3-(2-methylpropylsulfamoylmethyl)phenyl]-1,2-oxazole-3-carboxamide
CID 91954163
1-N,3-N,5-N-tris(3-ethylphenyl)benzene-1,3,5-tricarboxamide
CID 67992311
5-(4-chlorophenyl)-N-[3-[(4-methylpiperidin-1-yl)methyl]phenyl]-1,2-oxazole-3-carboxamide
CID 46952038

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide (CID 27285951) is N-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide is CCc1cccc(NC(=O)c2cc(-c3ccccc3)on2)c1.
What is the InChIKey of N-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide?
The InChIKey is SQWBUTZWSCHXOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-2-13-7-6-10-15(11-13)19-18(21)16-12-17(22-20-16)14-8-4-3-5-9-14/h3-12H,2H2,1H3,(H,19,21).
What are the key properties of N-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide?
N-(3-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-(3-ethylphenyl)-5-phenyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 27285951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).