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

C18H16N2O3 — CID 110681476

IUPACN-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cnc(-c2ccccc2)o1
InChIInChI=1S/C18H16N2O3/c1-2-22-15-11-7-6-10-14(15)20-17(21)16-12-19-18(23-16)13-8-4-3-5-9-13/h3-12H,2H2,1H3,(H,20,21)
InChIKeyXUDBVSDPGACAIM-UHFFFAOYSA-N
MW308.34 g/mol
LogP3.99
Rot. Bonds5

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

N-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide (PubChem CID 110681476) has the molecular formula C18H16N2O3 and a molecular weight of 308.34 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide
PubChem CID110681476
Molecular FormulaC18H16N2O3
Molecular Weight308.34 g/mol
Exact Mass308.12
IUPAC NameN-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cnc(-c2ccccc2)o1
InChIInChI=1S/C18H16N2O3/c1-2-22-15-11-7-6-10-14(15)20-17(21)16-12-19-18(23-16)13-8-4-3-5-9-13/h3-12H,2H2,1H3,(H,20,21)
InChIKeyXUDBVSDPGACAIM-UHFFFAOYSA-N
XLogP3.99
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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N-(2-ethoxyphenyl)-5-methyl-2-phenyl-1,3-thiazole-4-carboxamide
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5-[(4-acetylphenoxy)methyl]-N-(2-ethoxyphenyl)furan-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide (CID 110681476) is N-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide is CCOc1ccccc1NC(=O)c1cnc(-c2ccccc2)o1.
What is the InChIKey of N-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide?
The InChIKey is XUDBVSDPGACAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3/c1-2-22-15-11-7-6-10-14(15)20-17(21)16-12-19-18(23-16)13-8-4-3-5-9-13/h3-12H,2H2,1H3,(H,20,21).
What are the key properties of N-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide?
N-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide has a molecular weight of 308.34 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-phenyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 110681476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).