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

C16H14N2O3 — CID 17253049

IUPACN-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(-c2ccco2)on1
InChIInChI=1S/C16H14N2O3/c1-2-11-6-3-4-7-12(11)17-16(19)13-10-15(21-18-13)14-8-5-9-20-14/h3-10H,2H2,1H3,(H,17,19)
InChIKeyLJMXHNYOSYNPDF-UHFFFAOYSA-N
MW282.30 g/mol
LogP3.75
Rot. Bonds4

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

N-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (PubChem CID 17253049) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
PubChem CID17253049
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC NameN-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1cc(-c2ccco2)on1
InChIInChI=1S/C16H14N2O3/c1-2-11-6-3-4-7-12(11)17-16(19)13-10-15(21-18-13)14-8-5-9-20-14/h3-10H,2H2,1H3,(H,17,19)
InChIKeyLJMXHNYOSYNPDF-UHFFFAOYSA-N
XLogP3.75
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide (CID 17253049) is N-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is CCc1ccccc1NC(=O)c1cc(-c2ccco2)on1.
What is the InChIKey of N-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is LJMXHNYOSYNPDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-2-11-6-3-4-7-12(11)17-16(19)13-10-15(21-18-13)14-8-5-9-20-14/h3-10H,2H2,1H3,(H,17,19).
What are the key properties of N-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide?
N-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 17253049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).