N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide

C17H14N2O3 — CID 100771875

IUPACN-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide
SMILESCOc1cccc(NC(=O)c2conc2-c2ccccc2)c1
InChIInChI=1S/C17H14N2O3/c1-21-14-9-5-8-13(10-14)18-17(20)15-11-22-19-16(15)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,20)
InChIKeyYYCXQHKCQOAGGJ-UHFFFAOYSA-N
MW294.31 g/mol
LogP3.60
Rot. Bonds4

About N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide

N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide (PubChem CID 100771875) has the molecular formula C17H14N2O3 and a molecular weight of 294.31 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide
PubChem CID100771875
Molecular FormulaC17H14N2O3
Molecular Weight294.31 g/mol
Exact Mass294.10
IUPAC NameN-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide
SMILESCOc1cccc(NC(=O)c2conc2-c2ccccc2)c1
InChIInChI=1S/C17H14N2O3/c1-21-14-9-5-8-13(10-14)18-17(20)15-11-22-19-16(15)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,20)
InChIKeyYYCXQHKCQOAGGJ-UHFFFAOYSA-N
XLogP3.60
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methoxyphenyl)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
CID 665357
6-N-(3-methoxyphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099989
N-(3-methoxyphenyl)-2-methyl-6-phenylpyridine-3-carboxamide
CID 17498937
N-[2-[(3-methoxyphenyl)carbamoyl]phenyl]-3-phenyl-1,2-oxazole-5-carboxamide
CID 55666254
4-methoxy-N,2-diphenylbenzamide
CID 156739257
2-fluoro-N-(3-methoxyphenyl)benzamide
CID 2292975
2-acetamido-N-(3-methoxyphenyl)-5-phenylthiophene-3-carboxamide
CID 7673753
2-(4-methoxyanilino)-N-(3-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide
CID 2360763
3-methoxy-N-(3-phenylphenyl)benzamide
CID 798645
2-hydroxy-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 27167303
2-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-phenylbenzamide
CID 3730602
2-benzyl-N-(3-methoxyphenyl)benzamide
CID 26914636

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide (CID 100771875) is N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide is COc1cccc(NC(=O)c2conc2-c2ccccc2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide?
The InChIKey is YYCXQHKCQOAGGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3/c1-21-14-9-5-8-13(10-14)18-17(20)15-11-22-19-16(15)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,20).
What are the key properties of N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide?
N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-3-phenyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 100771875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).